methyl 3-(phenylcarbonylcarbamothioylamino)thiophene-2-carboxylate

Systemtic Name: methyl 3-(phenylcarbonylcarbamothioylamino)thiophene-2-carboxylate Openeye Name: methyl 3-(benzoylcarbamothioylamino)thiophene-2-carboxylate CAS Name: 3-[[benzamido(sulfanylidene)methyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-(benzoylcarbamothioylamino)thiophene-2-carboxylate Traditional Name: 3-(benzoylthiocarbamoylamino)thiophene-2-carboxylic acid methyl ester Formula: C14H12N2O3S2 MolecularWeight: 320.38668

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=S)NC(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=S)NC(=O)C2=CC=CC=C2

InChI

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