CHEBI:114669 - 7-(2-methyl-2,3-dihydroindol-1-yl)-3-(phenylmethyl)triazolo[4,5-d]pyrimidine

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ChEBI Name 7-(2-methyl-2,3-dihydroindol-1-yl)-3-(phenylmethyl)triazolo[4,5-d]pyrimidine
ChEBI ID CHEBI:114669
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C20H18N6
Net Charge 0
Average Mass 342.398
Monoisotopic Mass 342.15929
InChI InChI=1S/C20H18N6/c1-14-11-16-9-5-6-10-17(16)26(14)20-18-19(21-13-22-20)25(24-23-18)12-15-7-3-2-4-8-15/h2-10,13-14H,11-12H2,1H3
InChIKey CCUGFXABKVOWQL-UHFFFAOYSA-N
SMILES CC1CC2=CC=CC=C2N1C3=NC=NC4=C3N=NN4CC5=CC=CC=C5
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing 7-(2-methyl-2,3-dihydroindol-1-yl)-3-(phenylmethyl)triazolo[4,5-d]pyrimidine (CHEBI:114669) is a aromatic amine (CHEBI:33860)
7-(2-methyl-2,3-dihydroindol-1-yl)-3-(phenylmethyl)triazolo[4,5-d]pyrimidine (CHEBI:114669) is a tertiary amino compound (CHEBI:50996)
Manual Xref Database
LSM-26131 LINCS
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