ethyl 4-(4-chlorophenyl)-6-[(5-cyclohexyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(4-chlorophenyl)-6-[(5-cyclohexyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(4-chlorophenyl)-6-[(5-cyclohexyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(4-chlorophenyl)-6-[[(5-cyclohexyl-1,3,4-oxadiazol-2-yl)thio]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorophenyl)-6-[(5-cyclohexyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-(4-chlorophenyl)-6-[[(5-cyclohexyl-1,3,4-oxadiazol-2-yl)thio]methyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H25ClN4O4S MolecularWeight: 476.9763

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)Cl)CSC3=NN=C(O3)C4CCCCC4

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)Cl)CSC3=NN=C(O3)C4CCCCC4

InChI

InChI=1S/C22H25ClN4O4S/c1-2-30-20(28)17-16(24-21(29)25-18(17)13-8-10-15(23)11-9-13)12-32-22-27-26-19(31-22)14-6-4-3-5-7-14/h8-11,14,18H,2-7,12H2,1H3,(H2,24,25,29)