aziridine; diethyl 2-methyl-4-sulfanylidene-1H-pyrimidine-5,6-dicarboxylate

Systemtic Name: aziridine; diethyl 2-methyl-4-sulfanylidene-1H-pyrimidine-5,6-dicarboxylate Openeye Name: aziridine; diethyl 2-methyl-4-thioxo-1H-pyrimidine-5,6-dicarboxylate CAS Name: aziridine; 2-methyl-4-sulfanylidene-1H-pyrimidine-5,6-dicarboxylic acid diethyl ester IUPAC Name: aziridine; diethyl 2-methyl-4-sulfanylidene-1H-pyrimidine-5,6-dicarboxylate Traditional Name: ethylenimine; 2-methyl-4-thioxo-1H-pyrimidine-5,6-dicarboxylic acid diethyl ester Formula: C13H19N3O4S MolecularWeight: 313.37266

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=NC1=S)C)C(=O)OCC.C1CN1

Isomeric SMILES

CCOC(=O)C1=C(NC(=NC1=S)C)C(=O)OCC.C1CN1

InChI

InChI=1S/C11H14N2O4S.C2H5N/c1-4-16-10(14)7-8(11(15)17-5-2)12-6(3)13-9(7)18;1-2-3-1/h4-5H2,1-3H3,(H,12,13,18);3H,1-2H2