diethyl 5-(cyclohexylcarbamothioylamino)-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-(cyclohexylcarbamothioylamino)-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-(cyclohexylcarbamothioylamino)-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[(cyclohexylamino)-sulfanylidenemethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-(cyclohexylcarbamothioylamino)-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-(cyclohexylthiocarbamoylamino)-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C18H26N2O4S2 MolecularWeight: 398.54004

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=S)NC2CCCCC2

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=S)NC2CCCCC2

InChI

InChI=1S/C18H26N2O4S2/c1-4-23-16(21)13-11(3)14(17(22)24-5-2)26-15(13)20-18(25)19-12-9-7-6-8-10-12/h12H,4-10H2,1-3H3,(H2,19,20,25)