2-(2-cyclopentylethanoylamino)-N-[1,5-dimethyl-2,4-bis(oxidanylidene)-1,5-benzodiazepin-3-yl]-4-methylsulfanyl-butanamide

Systemtic Name: 2-(2-cyclopentylethanoylamino)-N-[1,5-dimethyl-2,4-bis(oxidanylidene)-1,5-benzodiazepin-3-yl]-4-methylsulfanyl-butanamide Openeye Name: 2-[(2-cyclopentylacetyl)amino]-N-(1,5-dimethyl-2,4-dioxo-1,5-benzodiazepin-3-yl)-4-methylsulfanyl-butanamide CAS Name: 2-[(2-cyclopentyl-1-oxoethyl)amino]-N-(1,5-dimethyl-2,4-dioxo-1,5-benzodiazepin-3-yl)-4-(methylthio)butanamide IUPAC Name: 2-[(2-cyclopentylacetyl)amino]-N-(1,5-dimethyl-2,4-dioxo-1,5-benzodiazepin-3-yl)-4-methylsulfanylbutanamide Traditional Name: 2-[(2-cyclopentylacetyl)amino]-N-(2,4-diketo-1,5-dimethyl-1,5-benzodiazepin-3-yl)-4-(methylthio)butyramide Formula: C23H32N4O4S MolecularWeight: 460.58958

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C(=O)C(C1=O)NC(=O)C(CCSC)NC(=O)CC3CCCC3)C

Isomeric SMILES

CN1C2=CC=CC=C2N(C(=O)C(C1=O)NC(=O)C(CCSC)NC(=O)CC3CCCC3)C

InChI

InChI=1S/C23H32N4O4S/c1-26-17-10-6-7-11-18(17)27(2)23(31)20(22(26)30)25-21(29)16(12-13-32-3)24-19(28)14-15-8-4-5-9-15/h6-7,10-11,15-16,20H,4-5,8-9,12-14H2,1-3H3,(H,24,28)(H,25,29)