3-acetamido-2-(4-aminophenyl)sulfanyl-4-chloranyl-benzoic acid

Systemtic Name: 3-acetamido-2-(4-aminophenyl)sulfanyl-4-chloranyl-benzoic acid Openeye Name: 3-acetamido-2-(4-aminophenyl)sulfanyl-4-chloro-benzoic acid CAS Name: 3-acetamido-2-[(4-aminophenyl)thio]-4-chlorobenzoic acid IUPAC Name: 3-acetamido-2-(4-aminophenyl)sulfanyl-4-chlorobenzoic acid Traditional Name: 3-acetamido-2-[(4-aminophenyl)thio]-4-chloro-benzoic acid Formula: C15H13ClN2O3S MolecularWeight: 336.79332

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1SC2=CC=C(C=C2)N)C(=O)O)Cl

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1SC2=CC=C(C=C2)N)C(=O)O)Cl

InChI

InChI=1S/C15H13ClN2O3S/c1-8(19)18-13-12(16)7-6-11(15(20)21)14(13)22-10-4-2-9(17)3-5-10/h2-7H,17H2,1H3,(H,18,19)(H,20,21)