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

Systemtic Name: diethyl 3-methyl-5-(nonylcarbamothioylamino)thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-(nonylcarbamothioylamino)thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[(nonylamino)-sulfanylidenemethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-(nonylcarbamothioylamino)thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-(nonylthiocarbamoylamino)thiophene-2,4-dicarboxylic acid diethyl ester Formula: C21H34N2O4S2 MolecularWeight: 442.63566

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCNC(=S)NC1=C(C(=C(S1)C(=O)OCC)C)C(=O)OCC

Isomeric SMILES

CCCCCCCCCNC(=S)NC1=C(C(=C(S1)C(=O)OCC)C)C(=O)OCC

InChI

InChI=1S/C21H34N2O4S2/c1-5-8-9-10-11-12-13-14-22-21(28)23-18-16(19(24)26-6-2)15(4)17(29-18)20(25)27-7-3/h5-14H2,1-4H3,(H2,22,23,28)