4-(5-cyclohexyl-2-oxidanylidene-3H-1,4-benzodiazepin-1-yl)-N-[4-(4-pyridin-4-ylpiperazin-1-yl)phenyl]butanamide

Systemtic Name: 4-(5-cyclohexyl-2-oxidanylidene-3H-1,4-benzodiazepin-1-yl)-N-[4-(4-pyridin-4-ylpiperazin-1-yl)phenyl]butanamide Openeye Name: 4-(5-cyclohexyl-2-oxo-3H-1,4-benzodiazepin-1-yl)-N-[4-[4-(4-pyridyl)piperazin-1-yl]phenyl]butanamide CAS Name: 4-(5-cyclohexyl-2-oxo-3H-1,4-benzodiazepin-1-yl)-N-[4-(4-pyridin-4-yl-1-piperazinyl)phenyl]butanamide IUPAC Name: 4-(5-cyclohexyl-2-oxo-3H-1,4-benzodiazepin-1-yl)-N-[4-(4-pyridin-4-ylpiperazin-1-yl)phenyl]butanamide Traditional Name: 4-(5-cyclohexyl-2-keto-3H-1,4-benzodiazepin-1-yl)-N-[4-[4-(4-pyridyl)piperazino]phenyl]butyramide Formula: C34H40N6O2 MolecularWeight: 564.7204

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NCC(=O)N(C3=CC=CC=C32)CCCC(=O)NC4=CC=C(C=C4)N5CCN(CC5)C6=CC=NC=C6

Isomeric SMILES

C1CCC(CC1)C2=NCC(=O)N(C3=CC=CC=C32)CCCC(=O)NC4=CC=C(C=C4)N5CCN(CC5)C6=CC=NC=C6

InChI

InChI=1S/C34H40N6O2/c41-32(37-27-12-14-28(15-13-27)38-21-23-39(24-22-38)29-16-18-35-19-17-29)11-6-20-40-31-10-5-4-9-30(31)34(36-25-33(40)42)26-7-2-1-3-8-26/h4-5,9-10,12-19,26H,1-3,6-8,11,20-25H2,(H,37,41)