N-(4-{1-[4-(4-acetylpiperazin-1-yl)-trans-cyclohexyl]-4-amino-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-2-methoxyphenyl)-1-methyl-1H-indole-2-carboxamide (CHEBI:43690)

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CHEBI:43690 - N-(4-{1-[4-(4-acetylpiperazin-1-yl)-trans-cyclohexyl]-4-amino-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-2-methoxyphenyl)-1-methyl-1H-indole-2-carboxamide

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ChEBI ID	CHEBI:43690
ChEBI Name	N-(4-{1-[4-(4-acetylpiperazin-1-yl)-trans-cyclohexyl]-4-amino-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-2-methoxyphenyl)-1-methyl-1H-indole-2-carboxamide
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ASCII Name	N-(4-{1-[4-(4-acetylpiperazin-1-yl)-trans-cyclohexyl]-4-amino-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-2-methoxyphenyl)-1-methyl-1H-indole-2-carboxamide
Last Modified	22 February 2018
Downloads	Molfile

Formula	C34H39N9O3
Net Charge	0
Average Mass	621.746
Monoisotopic Mass	621.31759
SMILES	[H]c1nc(N([H])[H])c2c(-c3c([H])c([H])c(N([H])C(=O)c4c([H])c5c([H])c([H])c([H])c([H])c5n4C([H])([H])[H])c(OC([H])([H])[H])c3[H])nn([C@]3([H])C([H])([H])C([H])([H])[C@@]([H])(N4C([H])([H])C([H])([H])N(C(=O)C([H])([H])[H])C([H])([H])C4([H])[H])C([H])([H])C3([H])[H])c2n1
InChI	InChI=1S/C34H39N9O3/c1-21(44)41-14-16-42(17-15-41)24-9-11-25(12-10-24)43-33-30(32(35)36-20-37-33)31(39-43)23-8-13-26(29(19-23)46-3)38-34(45)28-18-22-6-4-5-7-27(22)40(28)2/h4-8,13,18-20,24-25H,9-12,14-17H2,1-3H3,(H,38,45)(H2,35,36,37)/t24-,25-
InChIKey	ZMNWFTYYYCSSTF-SOAUALDESA-N

ChEBI Ontology

Outgoing Relation(s)
	N-(4-{1-[4-(4-acetylpiperazin-1-yl)-trans-cyclohexyl]-4-amino-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-2-methoxyphenyl)-1-methyl-1H-indole-2-carboxamide (CHEBI:43690) is a N-acylpiperazine (CHEBI:46844)
	N-(4-{1-[4-(4-acetylpiperazin-1-yl)-trans-cyclohexyl]-4-amino-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-2-methoxyphenyl)-1-methyl-1H-indole-2-carboxamide (CHEBI:43690) is a N-alkylpiperazine (CHEBI:46845)
	N-(4-{1-[4-(4-acetylpiperazin-1-yl)-trans-cyclohexyl]-4-amino-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-2-methoxyphenyl)-1-methyl-1H-indole-2-carboxamide (CHEBI:43690) is a indolecarboxamide (CHEBI:46921)
	N-(4-{1-[4-(4-acetylpiperazin-1-yl)-trans-cyclohexyl]-4-amino-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-2-methoxyphenyl)-1-methyl-1H-indole-2-carboxamide (CHEBI:43690) is a pyrazolopyrimidine (CHEBI:38669)

Synonyms	Source
N-(4-{1-[4-(4-acetylpiperazin-1-yl)-trans-cyclohexyl]-4-amino-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-2-methoxyphenyl)-1-methyl-1H-indole-2-carboxamide	PDBeChem
N-(4-{1-[trans-4-(4-acetylpiperazin-1-yl)cyclohexyl]-4-amino-1H-pyrazolo[3,4-d]pyrimidin-3-yl}-2-methoxyphenyl)-1-methyl-1H-indole-2-carboxamide	PDBeChem

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