methyl 3-[2-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[2-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-[2-(4-chloroanilino)-2-oxo-ethyl]sulfanylacetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[[2-(4-chloroanilino)-2-oxoethyl]thio]-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-[2-(4-chloroanilino)-2-oxoethyl]sulfanylacetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-[[2-(4-chloroanilino)-2-keto-ethyl]thio]acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C19H19ClN2O4S MolecularWeight: 406.88316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CSCC(=O)NC2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CSCC(=O)NC2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H19ClN2O4S/c1-12-3-4-13(19(25)26-2)9-16(12)22-18(24)11-27-10-17(23)21-15-7-5-14(20)6-8-15/h3-9H,10-11H2,1-2H3,(H,21,23)(H,22,24)