[2-(2,5-dimethylthiophen-3-yl)-2-oxidanylidene-ethyl] 2-[(2-chlorophenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: [2-(2,5-dimethylthiophen-3-yl)-2-oxidanylidene-ethyl] 2-[(2-chlorophenyl)carbonylamino]-3-methyl-butanoate Openeye Name: [2-(2,5-dimethyl-3-thienyl)-2-oxo-ethyl] 2-[(2-chlorobenzoyl)amino]-3-methyl-butanoate CAS Name: 2-[[(2-chlorophenyl)-oxomethyl]amino]-3-methylbutanoic acid [2-(2,5-dimethyl-3-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethylthiophen-3-yl)-2-oxoethyl] 2-[(2-chlorobenzoyl)amino]-3-methylbutanoate Traditional Name: 2-[(2-chlorobenzoyl)amino]-3-methyl-butyric acid [2-(2,5-dimethyl-3-thienyl)-2-keto-ethyl] ester Formula: C20H22ClNO4S MolecularWeight: 407.91098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)COC(=O)C(C(C)C)NC(=O)C2=CC=CC=C2Cl

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)COC(=O)C(C(C)C)NC(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C20H22ClNO4S/c1-11(2)18(22-19(24)14-7-5-6-8-16(14)21)20(25)26-10-17(23)15-9-12(3)27-13(15)4/h5-9,11,18H,10H2,1-4H3,(H,22,24)