2-(4-acetamido-3-methyl-phenyl)sulfanylbenzoic acid

Systemtic Name: 2-(4-acetamido-3-methyl-phenyl)sulfanylbenzoic acid Openeye Name: 2-(4-acetamido-3-methyl-phenyl)sulfanylbenzoic acid CAS Name: 2-[(4-acetamido-3-methylphenyl)thio]benzoic acid IUPAC Name: 2-(4-acetamido-3-methylphenyl)sulfanylbenzoic acid Traditional Name: 2-[(4-acetamido-3-methyl-phenyl)thio]benzoic acid Formula: C16H15NO3S MolecularWeight: 301.3602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)SC2=CC=CC=C2C(=O)O)NC(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)SC2=CC=CC=C2C(=O)O)NC(=O)C

InChI

InChI=1S/C16H15NO3S/c1-10-9-12(7-8-14(10)17-11(2)18)21-15-6-4-3-5-13(15)16(19)20/h3-9H,1-2H3,(H,17,18)(H,19,20)