ethyl 6-[(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanylmethyl]-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanylmethyl]-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[(3-cyano-4,5,6-trimethyl-2-pyridyl)sulfanylmethyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[(3-cyano-4,5,6-trimethyl-2-pyridinyl)thio]methyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanylmethyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[[(3-cyano-4,5,6-trimethyl-2-pyridyl)thio]methyl]-2-keto-4-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H22N4O3S MolecularWeight: 374.45728

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C)CSC2=NC(=C(C(=C2C#N)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C)CSC2=NC(=C(C(=C2C#N)C)C)C

InChI

InChI=1S/C18H22N4O3S/c1-6-25-17(23)15-12(5)21-18(24)22-14(15)8-26-16-13(7-19)10(3)9(2)11(4)20-16/h12H,6,8H2,1-5H3,(H2,21,22,24)