[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 4-oxidanylidene-4-thiophen-2-yl-butanoate

Systemtic Name: [2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 4-oxidanylidene-4-thiophen-2-yl-butanoate Openeye Name: [2-(3,5-dimethylanilino)-2-oxo-ethyl] 4-oxo-4-(2-thienyl)butanoate CAS Name: 4-oxo-4-thiophen-2-ylbutanoic acid [2-(3,5-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,5-dimethylanilino)-2-oxoethyl] 4-oxo-4-thiophen-2-ylbutanoate Traditional Name: 4-keto-4-(2-thienyl)butyric acid [2-(3,5-dimethylanilino)-2-keto-ethyl] ester Formula: C18H19NO4S MolecularWeight: 345.41276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)COC(=O)CCC(=O)C2=CC=CS2)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)COC(=O)CCC(=O)C2=CC=CS2)C

InChI

InChI=1S/C18H19NO4S/c1-12-8-13(2)10-14(9-12)19-17(21)11-23-18(22)6-5-15(20)16-4-3-7-24-16/h3-4,7-10H,5-6,11H2,1-2H3,(H,19,21)