ethyl 4-ethyl-2-(furan-2-ylmethylcarbamothioylamino)-5-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 4-ethyl-2-(furan-2-ylmethylcarbamothioylamino)-5-methyl-thiophene-3-carboxylate Openeye Name: ethyl 4-ethyl-2-(2-furylmethylcarbamothioylamino)-5-methyl-thiophene-3-carboxylate CAS Name: 4-ethyl-2-[[(2-furanylmethylamino)-sulfanylidenemethyl]amino]-5-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-ethyl-2-(furan-2-ylmethylcarbamothioylamino)-5-methylthiophene-3-carboxylate Traditional Name: 4-ethyl-2-(2-furfurylthiocarbamoylamino)-5-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C16H20N2O3S2 MolecularWeight: 352.4716

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OCC)NC(=S)NCC2=CC=CO2)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OCC)NC(=S)NCC2=CC=CO2)C

InChI

InChI=1S/C16H20N2O3S2/c1-4-12-10(3)23-14(13(12)15(19)20-5-2)18-16(22)17-9-11-7-6-8-21-11/h6-8H,4-5,9H2,1-3H3,(H2,17,18,22)