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

Systemtic Name: 4-(5-cyclohexyl-2-oxidanylidene-3H-1,4-benzodiazepin-1-yl)-N-[4-(4-piperidin-1-ylpiperidin-1-yl)phenyl]butanamide Openeye Name: 4-(5-cyclohexyl-2-oxo-3H-1,4-benzodiazepin-1-yl)-N-[4-[4-(1-piperidyl)-1-piperidyl]phenyl]butanamide CAS Name: 4-(5-cyclohexyl-2-oxo-3H-1,4-benzodiazepin-1-yl)-N-[4-[4-(1-piperidinyl)-1-piperidinyl]phenyl]butanamide IUPAC Name: 4-(5-cyclohexyl-2-oxo-3H-1,4-benzodiazepin-1-yl)-N-[4-(4-piperidin-1-ylpiperidin-1-yl)phenyl]butanamide Traditional Name: 4-(5-cyclohexyl-2-keto-3H-1,4-benzodiazepin-1-yl)-N-[4-(4-piperidinopiperidino)phenyl]butyramide Formula: C35H47N5O2 MolecularWeight: 569.77998

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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)N5CCC(CC5)N6CCCCC6

Isomeric SMILES

C1CCC(CC1)C2=NCC(=O)N(C3=CC=CC=C32)CCCC(=O)NC4=CC=C(C=C4)N5CCC(CC5)N6CCCCC6

InChI

InChI=1S/C35H47N5O2/c41-33(37-28-15-17-29(18-16-28)39-24-19-30(20-25-39)38-21-7-2-8-22-38)14-9-23-40-32-13-6-5-12-31(32)35(36-26-34(40)42)27-10-3-1-4-11-27/h5-6,12-13,15-18,27,30H,1-4,7-11,14,19-26H2,(H,37,41)