4-[(4-acetamidophenyl)sulfanylcarbamoylamino]-2-chloranyl-benzoic acid

Systemtic Name: 4-[(4-acetamidophenyl)sulfanylcarbamoylamino]-2-chloranyl-benzoic acid Openeye Name: 4-[(4-acetamidophenyl)sulfanylcarbamoylamino]-2-chloro-benzoic acid CAS Name: 4-[[[[(4-acetamidophenyl)thio]amino]-oxomethyl]amino]-2-chlorobenzoic acid IUPAC Name: 4-[(4-acetamidophenyl)sulfanylcarbamoylamino]-2-chlorobenzoic acid Traditional Name: 4-[[(4-acetamidophenyl)thio]carbamoylamino]-2-chloro-benzoic acid Formula: C16H14ClN3O4S MolecularWeight: 379.81806

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SNC(=O)NC2=CC(=C(C=C2)C(=O)O)Cl

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SNC(=O)NC2=CC(=C(C=C2)C(=O)O)Cl

InChI

InChI=1S/C16H14ClN3O4S/c1-9(21)18-10-2-5-12(6-3-10)25-20-16(24)19-11-4-7-13(15(22)23)14(17)8-11/h2-8H,1H3,(H,18,21)(H,22,23)(H2,19,20,24)