2-[(2S)-1-[(4-aminocarbonylphenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylbenzoate

Systemtic Name: 2-[(2S)-1-[(4-aminocarbonylphenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylbenzoate Openeye Name: 2-[(1S)-2-(4-carbamoylanilino)-1-methyl-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[(2S)-1-(4-carbamoylanilino)-1-oxopropan-2-yl]thio]benzoate IUPAC Name: 2-[(2S)-1-(4-carbamoylanilino)-1-oxopropan-2-yl]sulfanylbenzoate Traditional Name: 2-[[(1S)-2-(4-carbamoylanilino)-2-keto-1-methyl-ethyl]thio]benzoate Formula: C17H15N2O4S- MolecularWeight: 343.377

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(=O)N)SC2=CC=CC=C2C(=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)C(=O)N)SC2=CC=CC=C2C(=O)[O-]

InChI

InChI=1S/C17H16N2O4S/c1-10(24-14-5-3-2-4-13(14)17(22)23)16(21)19-12-8-6-11(7-9-12)15(18)20/h2-10H,1H3,(H2,18,20)(H,19,21)(H,22,23)/p-1/t10-/m0/s1