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CHEBI:39726 - 6,7-dimethoxy-4-{8-[(4-methylpiperazin-1-yl)sulfonyl]-3,4-dihydroisoquinolin-2-(1H)-yl}quinazoline

ChEBI IDCHEBI:39726
ChEBI Name6,7-dimethoxy-4-{8-[(4-methylpiperazin-1-yl)sulfonyl]-3,4-dihydroisoquinolin-2-(1H)-yl}quinazoline
Stars
ASCII Name6,7-dimethoxy-4-{8-[(4-methylpiperazin-1-yl)sulfonyl]-3,4-dihydroisoquinolin-2-(1H)-yl}quinazoline
Last Modified16 May 2008
DownloadsMolfile
FormulaC24H29N5O4S
Net Charge0
Average Mass483.594
Monoisotopic Mass483.19403
SMILES[H]c1nc(N2C([H])([H])c3c(c([H])c([H])c([H])c3S(=O)(=O)N3C([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])C3([H])[H])C([H])([H])C2([H])[H])c2c([H])c(OC([H])([H])[H])c(OC([H])([H])[H])c([H])c2n1
InChIInChI=1S/C24H29N5O4S/c1-27-9-11-29(12-10-27)34(30,31)23-6-4-5-17-7-8-28(15-19(17)23)24-18-13-21(32-2)22(33-3)14-20(18)25-16-26-24/h4-6,13-14,16H,7-12,15H2,1-3H3
InChIKeyXOFGGFSZAJCEEW-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
6,7-dimethoxy-4-{8-[(4-methylpiperazin-1-yl)sulfonyl]-3,4-dihydroisoquinolin-2-(1H)-yl}quinazoline (CHEBI:39726) is a N-methylpiperazine (CHEBI:46920)
6,7-dimethoxy-4-{8-[(4-methylpiperazin-1-yl)sulfonyl]-3,4-dihydroisoquinolin-2-(1H)-yl}quinazoline (CHEBI:39726) is a N-sulfonylpiperazine (CHEBI:46918)
6,7-dimethoxy-4-{8-[(4-methylpiperazin-1-yl)sulfonyl]-3,4-dihydroisoquinolin-2-(1H)-yl}quinazoline (CHEBI:39726) is a isoquinolines (CHEBI:24922)
6,7-dimethoxy-4-{8-[(4-methylpiperazin-1-yl)sulfonyl]-3,4-dihydroisoquinolin-2-(1H)-yl}quinazoline (CHEBI:39726) is a quinazolines (CHEBI:38530)
Synonyms  Source
6,7-DIMETHOXY-4-{8-[(4-METHYLPIPERAZIN-1-YL)SULFONYL]-3,4-DIHYDROISOQUINOLIN-2(1H)-YL}QUINAZOLINEPDBeChem
6,7-dimethoxy-4-{8-[(4-methylpiperazin-1-yl)sulfonyl]-3,4-dihydroisoquinolin-2(1H)-yl}quinazolinePDBeChem
Manual XrefsDatabases
227PDBeChem