(4-methylcyclohexyl) 4-(3-bromanyl-4-methoxy-phenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: (4-methylcyclohexyl) 4-(3-bromanyl-4-methoxy-phenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: (4-methylcyclohexyl) 4-(3-bromo-4-methoxy-phenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(3-bromo-4-methoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid (4-methylcyclohexyl) ester IUPAC Name: (4-methylcyclohexyl) 4-(3-bromo-4-methoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-(3-bromo-4-methoxy-phenyl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid (4-methylcyclohexyl) ester Formula: C20H25BrN2O4 MolecularWeight: 437.3275

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)OC(=O)C2=C(NC(=O)NC2C3=CC(=C(C=C3)OC)Br)C

Isomeric SMILES

CC1CCC(CC1)OC(=O)C2=C(NC(=O)NC2C3=CC(=C(C=C3)OC)Br)C

InChI

InChI=1S/C20H25BrN2O4/c1-11-4-7-14(8-5-11)27-19(24)17-12(2)22-20(25)23-18(17)13-6-9-16(26-3)15(21)10-13/h6,9-11,14,18H,4-5,7-8H2,1-3H3,(H2,22,23,25)