methyl 3-[(3-ethanoylphenyl)carbamothioylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[(3-ethanoylphenyl)carbamothioylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[(3-acetylphenyl)carbamothioylamino]thiophene-2-carboxylate CAS Name: 3-[[(3-acetylanilino)-sulfanylidenemethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(3-acetylphenyl)carbamothioylamino]thiophene-2-carboxylate Traditional Name: 3-[(3-acetylphenyl)thiocarbamoylamino]thiophene-2-carboxylic acid methyl ester Formula: C15H14N2O3S2 MolecularWeight: 334.41326

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=S)NC2=C(SC=C2)C(=O)OC

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=S)NC2=C(SC=C2)C(=O)OC

InChI

InChI=1S/C15H14N2O3S2/c1-9(18)10-4-3-5-11(8-10)16-15(21)17-12-6-7-22-13(12)14(19)20-2/h3-8H,1-2H3,(H2,16,17,21)