2-[2,5-bis(oxidanylidene)-3-(phenylmethyl)-1,3-dihydro-1,4-benzodiazepin-4-yl]-N-cyclohexyl-butanamide

Systemtic Name: 2-[2,5-bis(oxidanylidene)-3-(phenylmethyl)-1,3-dihydro-1,4-benzodiazepin-4-yl]-N-cyclohexyl-butanamide Openeye Name: 2-(3-benzyl-2,5-dioxo-1,3-dihydro-1,4-benzodiazepin-4-yl)-N-cyclohexyl-butanamide CAS Name: N-cyclohexyl-2-[2,5-dioxo-3-(phenylmethyl)-1,3-dihydro-1,4-benzodiazepin-4-yl]butanamide IUPAC Name: 2-(3-benzyl-2,5-dioxo-1,3-dihydro-1,4-benzodiazepin-4-yl)-N-cyclohexylbutanamide Traditional Name: 2-(3-benzyl-2,5-diketo-1,3-dihydro-1,4-benzodiazepin-4-yl)-N-cyclohexyl-butyramide Formula: C26H31N3O3 MolecularWeight: 433.54264

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1CCCCC1)N2C(C(=O)NC3=CC=CC=C3C2=O)CC4=CC=CC=C4

Isomeric SMILES

CCC(C(=O)NC1CCCCC1)N2C(C(=O)NC3=CC=CC=C3C2=O)CC4=CC=CC=C4

InChI

InChI=1S/C26H31N3O3/c1-2-22(24(30)27-19-13-7-4-8-14-19)29-23(17-18-11-5-3-6-12-18)25(31)28-21-16-10-9-15-20(21)26(29)32/h3,5-6,9-12,15-16,19,22-23H,2,4,7-8,13-14,17H2,1H3,(H,27,30)(H,28,31)