3-[2-methyl-4-[(1-methyl-2,4-dihydropyrazolo[4,3-c][1,5]benzodiazepin-5-yl)carbonyl]phenyl]-1-[4-(2-pyrrolidin-1-ylethylamino)piperidin-1-yl]propan-1-one

Systemtic Name: 3-[2-methyl-4-[(1-methyl-2,4-dihydropyrazolo[4,3-c][1,5]benzodiazepin-5-yl)carbonyl]phenyl]-1-[4-(2-pyrrolidin-1-ylethylamino)piperidin-1-yl]propan-1-one Openeye Name: 3-[2-methyl-4-(1-methyl-2,4-dihydropyrazolo[4,3-c][1,5]benzodiazepine-5-carbonyl)phenyl]-1-[4-(2-pyrrolidin-1-ylethylamino)-1-piperidyl]propan-1-one CAS Name: 3-[2-methyl-4-[(1-methyl-2,4-dihydropyrazolo[4,3-c][1,5]benzodiazepin-5-yl)-oxomethyl]phenyl]-1-[4-[2-(1-pyrrolidinyl)ethylamino]-1-piperidinyl]-1-propanone IUPAC Name: 3-[2-methyl-4-(1-methyl-2,4-dihydropyrazolo[4,3-c][1,5]benzodiazepine-5-carbonyl)phenyl]-1-[4-(2-pyrrolidin-1-ylethylamino)piperidin-1-yl]propan-1-one Traditional Name: 3-[2-methyl-4-(1-methyl-2,4-dihydropyrazolo[4,3-c][1,5]benzodiazepine-5-carbonyl)phenyl]-1-[4-(2-pyrrolidinoethylamino)piperidino]propan-1-one Formula: C33H43N7O2 MolecularWeight: 569.74022

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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)CCC(=O)N5CCC(CC5)NCCN6CCCC6

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CC3=CNN(C3=NC4=CC=CC=C42)C)CCC(=O)N5CCC(CC5)NCCN6CCCC6

InChI

InChI=1S/C33H43N7O2/c1-24-21-26(33(42)40-23-27-22-35-37(2)32(27)36-29-7-3-4-8-30(29)40)10-9-25(24)11-12-31(41)39-18-13-28(14-19-39)34-15-20-38-16-5-6-17-38/h3-4,7-10,21-22,28,34-35H,5-6,11-20,23H2,1-2H3