4-[[(4-methylsulfanylphenyl)carbonylamino]methyl]benzoic acid

Systemtic Name: 4-[[(4-methylsulfanylphenyl)carbonylamino]methyl]benzoic acid Openeye Name: 4-[[(4-methylsulfanylbenzoyl)amino]methyl]benzoic acid CAS Name: 4-[[[[4-(methylthio)phenyl]-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[(4-methylsulfanylbenzoyl)amino]methyl]benzoic acid Traditional Name: 4-[[[4-(methylthio)benzoyl]amino]methyl]benzoic acid Formula: C16H15NO3S MolecularWeight: 301.3602

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)NCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)NCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C16H15NO3S/c1-21-14-8-6-12(7-9-14)15(18)17-10-11-2-4-13(5-3-11)16(19)20/h2-9H,10H2,1H3,(H,17,18)(H,19,20)