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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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