N-cyclohexyl-3-methyl-2-(1-methylsulfonyl-5-oxidanylidene-2,3-dihydro-1,4-benzodiazepin-4-yl)butanamide

Systemtic Name: N-cyclohexyl-3-methyl-2-(1-methylsulfonyl-5-oxidanylidene-2,3-dihydro-1,4-benzodiazepin-4-yl)butanamide Openeye Name: N-cyclohexyl-3-methyl-2-(1-methylsulfonyl-5-oxo-2,3-dihydro-1,4-benzodiazepin-4-yl)butanamide CAS Name: N-cyclohexyl-3-methyl-2-(1-methylsulfonyl-5-oxo-2,3-dihydro-1,4-benzodiazepin-4-yl)butanamide IUPAC Name: N-cyclohexyl-3-methyl-2-(1-methylsulfonyl-5-oxo-2,3-dihydro-1,4-benzodiazepin-4-yl)butanamide Traditional Name: N-cyclohexyl-2-(5-keto-1-mesyl-2,3-dihydro-1,4-benzodiazepin-4-yl)-3-methyl-butyramide Formula: C21H31N3O4S MolecularWeight: 421.55354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1CCCCC1)N2CCN(C3=CC=CC=C3C2=O)S(=O)(=O)C

Isomeric SMILES

CC(C)C(C(=O)NC1CCCCC1)N2CCN(C3=CC=CC=C3C2=O)S(=O)(=O)C

InChI

InChI=1S/C21H31N3O4S/c1-15(2)19(20(25)22-16-9-5-4-6-10-16)23-13-14-24(29(3,27)28)18-12-8-7-11-17(18)21(23)26/h7-8,11-12,15-16,19H,4-6,9-10,13-14H2,1-3H3,(H,22,25)