[2-[(4-acetamidophenyl)amino]-2-oxidanylidene-ethyl] 2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoate

Systemtic Name: [2-[(4-acetamidophenyl)amino]-2-oxidanylidene-ethyl] 2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoate Openeye Name: [2-(4-acetamidoanilino)-2-oxo-ethyl] 2-[(5-chloro-2-thienyl)methylsulfanyl]acetate CAS Name: 2-[(5-chloro-2-thiophenyl)methylthio]acetic acid [2-(4-acetamidoanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-acetamidoanilino)-2-oxoethyl] 2-[(5-chlorothiophen-2-yl)methylsulfanyl]acetate Traditional Name: 2-[(5-chloro-2-thienyl)methylthio]acetic acid [2-(4-acetamidoanilino)-2-keto-ethyl] ester Formula: C17H17ClN2O4S2 MolecularWeight: 412.91088

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)COC(=O)CSCC2=CC=C(S2)Cl

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)COC(=O)CSCC2=CC=C(S2)Cl

InChI

InChI=1S/C17H17ClN2O4S2/c1-11(21)19-12-2-4-13(5-3-12)20-16(22)8-24-17(23)10-25-9-14-6-7-15(18)26-14/h2-7H,8-10H2,1H3,(H,19,21)(H,20,22)