ethyl 3-(6-bromanylhexyl)-4-methyl-2-oxidanylidene-6-phenyl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 3-(6-bromanylhexyl)-4-methyl-2-oxidanylidene-6-phenyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-(6-bromohexyl)-4-methyl-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-(6-bromohexyl)-4-methyl-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(6-bromohexyl)-4-methyl-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-(6-bromohexyl)-2-keto-4-methyl-6-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C20H27BrN2O3 MolecularWeight: 423.34398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=CC=CC=C2)CCCCCCBr)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)NC1C2=CC=CC=C2)CCCCCCBr)C

InChI

InChI=1S/C20H27BrN2O3/c1-3-26-19(24)17-15(2)23(14-10-5-4-9-13-21)20(25)22-18(17)16-11-7-6-8-12-16/h6-8,11-12,18H,3-5,9-10,13-14H2,1-2H3,(H,22,25)