[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoate

Systemtic Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoate Openeye Name: [2-(p-tolyl)thiazol-4-yl]methyl 4-(5-chloro-2-thienyl)-4-oxo-butanoate CAS Name: 4-(5-chloro-2-thiophenyl)-4-oxobutanoic acid [2-(4-methylphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl 4-(5-chlorothiophen-2-yl)-4-oxobutanoate Traditional Name: 4-(5-chloro-2-thienyl)-4-keto-butyric acid [2-(p-tolyl)thiazol-4-yl]methyl ester Formula: C19H16ClNO3S2 MolecularWeight: 405.91824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)CCC(=O)C3=CC=C(S3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)COC(=O)CCC(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C19H16ClNO3S2/c1-12-2-4-13(5-3-12)19-21-14(11-25-19)10-24-18(23)9-6-15(22)16-7-8-17(20)26-16/h2-5,7-8,11H,6,9-10H2,1H3