N-[[2-methyl-4-[(1-methyl-2,4-dihydropyrazolo[4,3-c][1,5]benzodiazepin-5-yl)carbonyl]phenyl]methyl]-4-(1H-pyrrol-2-ylmethyl)piperazine-1-carboxamide

Systemtic Name: N-[[2-methyl-4-[(1-methyl-2,4-dihydropyrazolo[4,3-c][1,5]benzodiazepin-5-yl)carbonyl]phenyl]methyl]-4-(1H-pyrrol-2-ylmethyl)piperazine-1-carboxamide Openeye Name: N-[[2-methyl-4-(1-methyl-2,4-dihydropyrazolo[4,3-c][1,5]benzodiazepine-5-carbonyl)phenyl]methyl]-4-(1H-pyrrol-2-ylmethyl)piperazine-1-carboxamide CAS Name: N-[[2-methyl-4-[(1-methyl-2,4-dihydropyrazolo[4,3-c][1,5]benzodiazepin-5-yl)-oxomethyl]phenyl]methyl]-4-(1H-pyrrol-2-ylmethyl)-1-piperazinecarboxamide IUPAC Name: N-[[2-methyl-4-(1-methyl-2,4-dihydropyrazolo[4,3-c][1,5]benzodiazepine-5-carbonyl)phenyl]methyl]-4-(1H-pyrrol-2-ylmethyl)piperazine-1-carboxamide Traditional Name: N-[2-methyl-4-(1-methyl-2,4-dihydropyrazolo[4,3-c][1,5]benzodiazepine-5-carbonyl)benzyl]-4-(1H-pyrrol-2-ylmethyl)piperazine-1-carboxamide Formula: C30H34N8O2 MolecularWeight: 538.64336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2CC3=CNN(C3=NC4=CC=CC=C42)C)CNC(=O)N5CCN(CC5)CC6=CC=CN6

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CC3=CNN(C3=NC4=CC=CC=C42)C)CNC(=O)N5CCN(CC5)CC6=CC=CN6

InChI

InChI=1S/C30H34N8O2/c1-21-16-22(29(39)38-19-24-18-33-35(2)28(24)34-26-7-3-4-8-27(26)38)9-10-23(21)17-32-30(40)37-14-12-36(13-15-37)20-25-6-5-11-31-25/h3-11,16,18,31,33H,12-15,17,19-20H2,1-2H3,(H,32,40)