methyl 3-[[2-[(4-aminocarbonylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylmethyl]benzoate

Systemtic Name: methyl 3-[[2-[(4-aminocarbonylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylmethyl]benzoate Openeye Name: methyl 3-[[2-(4-carbamoylanilino)-2-oxo-ethyl]sulfanylmethyl]benzoate CAS Name: 3-[[[2-(4-carbamoylanilino)-2-oxoethyl]thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(4-carbamoylanilino)-2-oxoethyl]sulfanylmethyl]benzoate Traditional Name: 3-[[[2-(4-carbamoylanilino)-2-keto-ethyl]thio]methyl]benzoic acid methyl ester Formula: C18H18N2O4S MolecularWeight: 358.41152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)CSCC(=O)NC2=CC=C(C=C2)C(=O)N

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)CSCC(=O)NC2=CC=C(C=C2)C(=O)N

InChI

InChI=1S/C18H18N2O4S/c1-24-18(23)14-4-2-3-12(9-14)10-25-11-16(21)20-15-7-5-13(6-8-15)17(19)22/h2-9H,10-11H2,1H3,(H2,19,22)(H,20,21)