3-methyl-2-(2-phenylethanethioylamino)benzoic acid

Systemtic Name: 3-methyl-2-(2-phenylethanethioylamino)benzoic acid Openeye Name: 3-methyl-2-[(2-phenylethanethioyl)amino]benzoic acid CAS Name: 3-methyl-2-[(2-phenyl-1-sulfanylideneethyl)amino]benzoic acid IUPAC Name: 3-methyl-2-[(2-phenylethanethioyl)amino]benzoic acid Traditional Name: 3-methyl-2-[(2-phenylthioacetyl)amino]benzoic acid Formula: C16H15NO2S MolecularWeight: 285.3608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1NC(=S)CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC1=CC=CC(=C1NC(=S)CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H15NO2S/c1-11-6-5-9-13(16(18)19)15(11)17-14(20)10-12-7-3-2-4-8-12/h2-9H,10H2,1H3,(H,17,20)(H,18,19)