ethyl 5-ethyl-2-(phenylcarbonylcarbamothioylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-(phenylcarbonylcarbamothioylamino)thiophene-3-carboxylate Openeye Name: ethyl 2-(benzoylcarbamothioylamino)-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[benzamido(sulfanylidene)methyl]amino]-5-ethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(benzoylcarbamothioylamino)-5-ethylthiophene-3-carboxylate Traditional Name: 2-(benzoylthiocarbamoylamino)-5-ethyl-thiophene-3-carboxylic acid ethyl ester Formula: C17H18N2O3S2 MolecularWeight: 362.46642

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=S)NC(=O)C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=S)NC(=O)C2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C17H18N2O3S2/c1-3-12-10-13(16(21)22-4-2)15(24-12)19-17(23)18-14(20)11-8-6-5-7-9-11/h5-10H,3-4H2,1-2H3,(H2,18,19,20,23)