methyl 2-[[2-methyl-3-(2-phenylsulfanylethanoylamino)phenyl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[2-methyl-3-(2-phenylsulfanylethanoylamino)phenyl]carbonylamino]benzoate Openeye Name: methyl 2-[[2-methyl-3-[(2-phenylsulfanylacetyl)amino]benzoyl]amino]benzoate CAS Name: 2-[[[2-methyl-3-[[1-oxo-2-(phenylthio)ethyl]amino]phenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-methyl-3-[(2-phenylsulfanylacetyl)amino]benzoyl]amino]benzoate Traditional Name: 2-[[2-methyl-3-[[2-(phenylthio)acetyl]amino]benzoyl]amino]benzoic acid methyl ester Formula: C24H22N2O4S MolecularWeight: 434.50748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)CSC2=CC=CC=C2)C(=O)NC3=CC=CC=C3C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)CSC2=CC=CC=C2)C(=O)NC3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C24H22N2O4S/c1-16-18(23(28)26-21-13-7-6-11-19(21)24(29)30-2)12-8-14-20(16)25-22(27)15-31-17-9-4-3-5-10-17/h3-14H,15H2,1-2H3,(H,25,27)(H,26,28)