diethyl 1-ethyl-3-phenyl-4-sulfanylidene-1,3-diazinane-5,5-dicarboxylate

Systemtic Name: diethyl 1-ethyl-3-phenyl-4-sulfanylidene-1,3-diazinane-5,5-dicarboxylate Openeye Name: diethyl 1-ethyl-3-phenyl-4-thioxo-hexahydropyrimidine-5,5-dicarboxylate CAS Name: 1-ethyl-3-phenyl-4-sulfanylidene-1,3-diazinane-5,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 1-ethyl-3-phenyl-4-sulfanylidene-1,3-diazinane-5,5-dicarboxylate Traditional Name: 1-ethyl-3-phenyl-4-thioxo-hexahydropyrimidine-5,5-dicarboxylic acid diethyl ester Formula: C18H24N2O4S MolecularWeight: 364.45916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(C(=S)N(C1)C2=CC=CC=C2)(C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCN1CC(C(=S)N(C1)C2=CC=CC=C2)(C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C18H24N2O4S/c1-4-19-12-18(16(21)23-5-2,17(22)24-6-3)15(25)20(13-19)14-10-8-7-9-11-14/h7-11H,4-6,12-13H2,1-3H3