4-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: 4-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: 4-[2-(3-methylanilino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 4-[[2-(3-methylanilino)-2-oxoethyl]thio]benzoate IUPAC Name: 4-[2-(3-methylanilino)-2-oxoethyl]sulfanylbenzoate Traditional Name: 4-[[2-keto-2-(m-toluidino)ethyl]thio]benzoate Formula: C16H14NO3S- MolecularWeight: 300.35226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSC2=CC=C(C=C2)C(=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSC2=CC=C(C=C2)C(=O)[O-]

InChI

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