cyclohexyl 1-methyl-4-methylsulfanyl-6-oxidanylidene-3-phenyl-2-sulfanylidene-pyrimidine-5-carboxylate

Systemtic Name: cyclohexyl 1-methyl-4-methylsulfanyl-6-oxidanylidene-3-phenyl-2-sulfanylidene-pyrimidine-5-carboxylate Openeye Name: cyclohexyl 1-methyl-4-methylsulfanyl-6-oxo-3-phenyl-2-thioxo-pyrimidine-5-carboxylate CAS Name: 1-methyl-4-(methylthio)-6-oxo-3-phenyl-2-sulfanylidene-5-pyrimidinecarboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl 1-methyl-4-methylsulfanyl-6-oxo-3-phenyl-2-sulfanylidenepyrimidine-5-carboxylate Traditional Name: 6-keto-1-methyl-4-(methylthio)-3-phenyl-2-thioxo-pyrimidine-5-carboxylic acid cyclohexyl ester Formula: C19H22N2O3S2 MolecularWeight: 390.51958

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(N(C1=S)C2=CC=CC=C2)SC)C(=O)OC3CCCCC3

Isomeric SMILES

CN1C(=O)C(=C(N(C1=S)C2=CC=CC=C2)SC)C(=O)OC3CCCCC3

InChI

InChI=1S/C19H22N2O3S2/c1-20-16(22)15(18(23)24-14-11-7-4-8-12-14)17(26-2)21(19(20)25)13-9-5-3-6-10-13/h3,5-6,9-10,14H,4,7-8,11-12H2,1-2H3