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

Systemtic Name: diethyl 5-(dipentylcarbamothioylamino)-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-(dipentylcarbamothioylamino)-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[(dipentylamino)-sulfanylidenemethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-(dipentylcarbamothioylamino)-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-(diamylthiocarbamoylamino)-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C22H36N2O4S2 MolecularWeight: 456.66224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)C(=S)NC1=C(C(=C(S1)C(=O)OCC)C)C(=O)OCC

Isomeric SMILES

CCCCCN(CCCCC)C(=S)NC1=C(C(=C(S1)C(=O)OCC)C)C(=O)OCC

InChI

InChI=1S/C22H36N2O4S2/c1-6-10-12-14-24(15-13-11-7-2)22(29)23-19-17(20(25)27-8-3)16(5)18(30-19)21(26)28-9-4/h6-15H2,1-5H3,(H,23,29)