dimethyl 5-(dihexylcarbamothioylamino)-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-(dihexylcarbamothioylamino)-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-(dihexylcarbamothioylamino)-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[(dihexylamino)-sulfanylidenemethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-(dihexylcarbamothioylamino)-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-(dihexylthiocarbamoylamino)-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C22H36N2O4S2 MolecularWeight: 456.66224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCCCCC)C(=S)NC1=C(C(=C(S1)C(=O)OC)C)C(=O)OC

Isomeric SMILES

CCCCCCN(CCCCCC)C(=S)NC1=C(C(=C(S1)C(=O)OC)C)C(=O)OC

InChI

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