methyl 4-ethyl-5-methyl-2-[(4-methylcyclohexyl)carbamothioylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-ethyl-5-methyl-2-[(4-methylcyclohexyl)carbamothioylamino]thiophene-3-carboxylate Openeye Name: methyl 4-ethyl-5-methyl-2-[(4-methylcyclohexyl)carbamothioylamino]thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-[[[(4-methylcyclohexyl)amino]-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-ethyl-5-methyl-2-[(4-methylcyclohexyl)carbamothioylamino]thiophene-3-carboxylate Traditional Name: 4-ethyl-5-methyl-2-[(4-methylcyclohexyl)thiocarbamoylamino]thiophene-3-carboxylic acid methyl ester Formula: C17H26N2O2S2 MolecularWeight: 354.53054

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OC)NC(=S)NC2CCC(CC2)C)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OC)NC(=S)NC2CCC(CC2)C)C

InChI

InChI=1S/C17H26N2O2S2/c1-5-13-11(3)23-15(14(13)16(20)21-4)19-17(22)18-12-8-6-10(2)7-9-12/h10,12H,5-9H2,1-4H3,(H2,18,19,22)