ethyl 4-ethyl-5-methyl-2-(2-methylprop-2-enylcarbamothioylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4-ethyl-5-methyl-2-(2-methylprop-2-enylcarbamothioylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-ethyl-5-methyl-2-(2-methylallylcarbamothioylamino)thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-[[(2-methylprop-2-enylamino)-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-ethyl-5-methyl-2-(2-methylprop-2-enylcarbamothioylamino)thiophene-3-carboxylate Traditional Name: 4-ethyl-5-methyl-2-(2-methylallylthiocarbamoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C15H22N2O2S2 MolecularWeight: 326.47738

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OCC)NC(=S)NCC(=C)C)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OCC)NC(=S)NCC(=C)C)C

InChI

InChI=1S/C15H22N2O2S2/c1-6-11-10(5)21-13(12(11)14(18)19-7-2)17-15(20)16-8-9(3)4/h3,6-8H2,1-2,4-5H3,(H2,16,17,20)