4-methyl-3-(thiophen-2-ylcarbonylcarbamothioylamino)benzoic acid

Systemtic Name: 4-methyl-3-(thiophen-2-ylcarbonylcarbamothioylamino)benzoic acid Openeye Name: 4-methyl-3-(thiophene-2-carbonylcarbamothioylamino)benzoic acid CAS Name: 4-methyl-3-[[[[oxo(thiophen-2-yl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid IUPAC Name: 4-methyl-3-(thiophene-2-carbonylcarbamothioylamino)benzoic acid Traditional Name: 4-methyl-3-(2-thenoylthiocarbamoylamino)benzoic acid Formula: C14H12N2O3S2 MolecularWeight: 320.38668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NC(=S)NC(=O)C2=CC=CS2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NC(=S)NC(=O)C2=CC=CS2

InChI

InChI=1S/C14H12N2O3S2/c1-8-4-5-9(13(18)19)7-10(8)15-14(20)16-12(17)11-3-2-6-21-11/h2-7H,1H3,(H,18,19)(H2,15,16,17,20)