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

Systemtic Name: ethyl 2-[2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]benzoate Openeye Name: ethyl 2-[[2-[2-(3-methylanilino)-2-oxo-ethyl]sulfanylacetyl]amino]benzoate CAS Name: 2-[[2-[[2-(3-methylanilino)-2-oxoethyl]thio]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[2-[2-(3-methylanilino)-2-oxoethyl]sulfanylacetyl]amino]benzoate Traditional Name: 2-[[2-[[2-keto-2-(m-toluidino)ethyl]thio]acetyl]amino]benzoic acid ethyl ester Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)CSCC(=O)NC2=CC=CC(=C2)C

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)CSCC(=O)NC2=CC=CC(=C2)C

InChI

InChI=1S/C20H22N2O4S/c1-3-26-20(25)16-9-4-5-10-17(16)22-19(24)13-27-12-18(23)21-15-8-6-7-14(2)11-15/h4-11H,3,12-13H2,1-2H3,(H,21,23)(H,22,24)