5-chloranyl-2-[(2-methoxy-3-methyl-phenyl)carbonylcarbamothioylamino]benzoic acid

Systemtic Name: 5-chloranyl-2-[(2-methoxy-3-methyl-phenyl)carbonylcarbamothioylamino]benzoic acid Openeye Name: 5-chloro-2-[(2-methoxy-3-methyl-benzoyl)carbamothioylamino]benzoic acid CAS Name: 5-chloro-2-[[[[(2-methoxy-3-methylphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzoic acid IUPAC Name: 5-chloro-2-[(2-methoxy-3-methylbenzoyl)carbamothioylamino]benzoic acid Traditional Name: 5-chloro-2-[(2-methoxy-3-methyl-benzoyl)thiocarbamoylamino]benzoic acid Formula: C17H15ClN2O4S MolecularWeight: 378.83

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1OC)C(=O)NC(=S)NC2=C(C=C(C=C2)Cl)C(=O)O

Isomeric SMILES

CC1=CC=CC(=C1OC)C(=O)NC(=S)NC2=C(C=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C17H15ClN2O4S/c1-9-4-3-5-11(14(9)24-2)15(21)20-17(25)19-13-7-6-10(18)8-12(13)16(22)23/h3-8H,1-2H3,(H,22,23)(H2,19,20,21,25)