[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 4-(4-methyl-2-oxidanylidene-1,3-thiazol-3-yl)butanoate

Systemtic Name: [2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 4-(4-methyl-2-oxidanylidene-1,3-thiazol-3-yl)butanoate Openeye Name: [2-(3,4-dimethylanilino)-2-oxo-ethyl] 4-(4-methyl-2-oxo-thiazol-3-yl)butanoate CAS Name: 4-(4-methyl-2-oxo-3-thiazolyl)butanoic acid [2-(3,4-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethylanilino)-2-oxoethyl] 4-(4-methyl-2-oxo-1,3-thiazol-3-yl)butanoate Traditional Name: 4-(2-keto-4-methyl-4-thiazolin-3-yl)butyric acid [2-(3,4-dimethylanilino)-2-keto-ethyl] ester Formula: C18H22N2O4S MolecularWeight: 362.44328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC(=O)CCCN2C(=CSC2=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC(=O)CCCN2C(=CSC2=O)C)C

InChI

InChI=1S/C18H22N2O4S/c1-12-6-7-15(9-13(12)2)19-16(21)10-24-17(22)5-4-8-20-14(3)11-25-18(20)23/h6-7,9,11H,4-5,8,10H2,1-3H3,(H,19,21)