4-[(3-methoxycarbonyl-5-methyl-thiophen-2-yl)carbamothioylamino]benzoic acid

Systemtic Name: 4-[(3-methoxycarbonyl-5-methyl-thiophen-2-yl)carbamothioylamino]benzoic acid Openeye Name: 4-[(3-methoxycarbonyl-5-methyl-2-thienyl)carbamothioylamino]benzoic acid CAS Name: 4-[[[(3-methoxycarbonyl-5-methyl-2-thiophenyl)amino]-sulfanylidenemethyl]amino]benzoic acid IUPAC Name: 4-[(3-methoxycarbonyl-5-methylthiophen-2-yl)carbamothioylamino]benzoic acid Traditional Name: 4-[(3-carbomethoxy-5-methyl-2-thienyl)thiocarbamoylamino]benzoic acid Formula: C15H14N2O4S2 MolecularWeight: 350.41266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=S)NC2=CC=C(C=C2)C(=O)O)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=S)NC2=CC=C(C=C2)C(=O)O)C(=O)OC

InChI

InChI=1S/C15H14N2O4S2/c1-8-7-11(14(20)21-2)12(23-8)17-15(22)16-10-5-3-9(4-6-10)13(18)19/h3-7H,1-2H3,(H,18,19)(H2,16,17,22)