1-(3,3-dimethylbutyl)-N-[[4-[(1,8-dimethyl-2,4-dihydropyrazolo[4,3-c][1,5]benzodiazepin-5-yl)carbonyl]-3-methyl-phenyl]methyl]piperidine-4-carboxamide

Systemtic Name: 1-(3,3-dimethylbutyl)-N-[[4-[(1,8-dimethyl-2,4-dihydropyrazolo[4,3-c][1,5]benzodiazepin-5-yl)carbonyl]-3-methyl-phenyl]methyl]piperidine-4-carboxamide Openeye Name: 1-(3,3-dimethylbutyl)-N-[[4-(1,8-dimethyl-2,4-dihydropyrazolo[4,3-c][1,5]benzodiazepine-5-carbonyl)-3-methyl-phenyl]methyl]piperidine-4-carboxamide CAS Name: 1-(3,3-dimethylbutyl)-N-[[4-[(1,8-dimethyl-2,4-dihydropyrazolo[4,3-c][1,5]benzodiazepin-5-yl)-oxomethyl]-3-methylphenyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-(3,3-dimethylbutyl)-N-[[4-(1,8-dimethyl-2,4-dihydropyrazolo[4,3-c][1,5]benzodiazepine-5-carbonyl)-3-methylphenyl]methyl]piperidine-4-carboxamide Traditional Name: 1-(3,3-dimethylbutyl)-N-[4-(1,8-dimethyl-2,4-dihydropyrazolo[4,3-c][1,5]benzodiazepine-5-carbonyl)-3-methyl-benzyl]isonipecotamide Formula: C33H44N6O2 MolecularWeight: 556.74146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(CC3=CNN(C3=N2)C)C(=O)C4=C(C=C(C=C4)CNC(=O)C5CCN(CC5)CCC(C)(C)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(CC3=CNN(C3=N2)C)C(=O)C4=C(C=C(C=C4)CNC(=O)C5CCN(CC5)CCC(C)(C)C)C

InChI

InChI=1S/C33H44N6O2/c1-22-7-10-29-28(17-22)36-30-26(20-35-37(30)6)21-39(29)32(41)27-9-8-24(18-23(27)2)19-34-31(40)25-11-14-38(15-12-25)16-13-33(3,4)5/h7-10,17-18,20,25,35H,11-16,19,21H2,1-6H3,(H,34,40)