diethyl 3-(2-methylpropyl)-2-sulfanylidene-1H-imidazole-4,5-dicarboxylate

Systemtic Name: diethyl 3-(2-methylpropyl)-2-sulfanylidene-1H-imidazole-4,5-dicarboxylate Openeye Name: diethyl 3-isobutyl-2-thioxo-1H-imidazole-4,5-dicarboxylate CAS Name: 3-(2-methylpropyl)-2-sulfanylidene-1H-imidazole-4,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-(2-methylpropyl)-2-sulfanylidene-1H-imidazole-4,5-dicarboxylate Traditional Name: 1-isobutyl-2-thioxo-4-imidazoline-4,5-dicarboxylic acid diethyl ester Formula: C13H20N2O4S MolecularWeight: 300.3739

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=S)N1)CC(C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(N(C(=S)N1)CC(C)C)C(=O)OCC

InChI

InChI=1S/C13H20N2O4S/c1-5-18-11(16)9-10(12(17)19-6-2)15(7-8(3)4)13(20)14-9/h8H,5-7H2,1-4H3,(H,14,20)