diethyl 3-methyl-5-[1-(oxolan-2-yl)ethylcarbamothioylamino]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[1-(oxolan-2-yl)ethylcarbamothioylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-(1-tetrahydrofuran-2-ylethylcarbamothioylamino)thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[[1-(2-oxolanyl)ethylamino]-sulfanylidenemethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[1-(oxolan-2-yl)ethylcarbamothioylamino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[1-(tetrahydrofuryl)ethylthiocarbamoylamino]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C18H26N2O5S2 MolecularWeight: 414.53944

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=S)NC(C)C2CCCO2

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=S)NC(C)C2CCCO2

InChI

InChI=1S/C18H26N2O5S2/c1-5-23-16(21)13-10(3)14(17(22)24-6-2)27-15(13)20-18(26)19-11(4)12-8-7-9-25-12/h11-12H,5-9H2,1-4H3,(H2,19,20,26)