2-[[(4-chlorophenyl)carbamothioyl-methyl-amino]carbamoyl]benzoic acid

Systemtic Name: 2-[[(4-chlorophenyl)carbamothioyl-methyl-amino]carbamoyl]benzoic acid Openeye Name: 2-[[(4-chlorophenyl)carbamothioyl-methyl-amino]carbamoyl]benzoic acid CAS Name: 2-[[2-[(4-chloroanilino)-sulfanylidenemethyl]-2-methylhydrazinyl]-oxomethyl]benzoic acid IUPAC Name: 2-[[(4-chlorophenyl)carbamothioyl-methylamino]carbamoyl]benzoic acid Traditional Name: 2-[[(4-chlorophenyl)thiocarbamoyl-methyl-amino]carbamoyl]benzoic acid Formula: C16H14ClN3O3S MolecularWeight: 363.81866

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)NC1=CC=C(C=C1)Cl)NC(=O)C2=CC=CC=C2C(=O)O

Isomeric SMILES

CN(C(=S)NC1=CC=C(C=C1)Cl)NC(=O)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C16H14ClN3O3S/c1-20(16(24)18-11-8-6-10(17)7-9-11)19-14(21)12-4-2-3-5-13(12)15(22)23/h2-9H,1H3,(H,18,24)(H,19,21)(H,22,23)