methyl 3-[2-[[4-chloranyl-2-(phenylcarbonyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanylpropanoate

Systemtic Name: methyl 3-[2-[[4-chloranyl-2-(phenylcarbonyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanylpropanoate Openeye Name: methyl 3-[2-(2-benzoyl-4-chloro-anilino)-2-oxo-ethyl]sulfanylpropanoate CAS Name: 3-[[2-(2-benzoyl-4-chloroanilino)-2-oxoethyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[2-(2-benzoyl-4-chloroanilino)-2-oxoethyl]sulfanylpropanoate Traditional Name: 3-[[2-(2-benzoyl-4-chloro-anilino)-2-keto-ethyl]thio]propionic acid methyl ester Formula: C19H18ClNO4S MolecularWeight: 391.86852

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSCC(=O)NC1=C(C=C(C=C1)Cl)C(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)CCSCC(=O)NC1=C(C=C(C=C1)Cl)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H18ClNO4S/c1-25-18(23)9-10-26-12-17(22)21-16-8-7-14(20)11-15(16)19(24)13-5-3-2-4-6-13/h2-8,11H,9-10,12H2,1H3,(H,21,22)