ethyl 2-[4-(diphenylmethyl)piperazin-1-yl]-4-(3-ethoxy-4-oxidanyl-phenyl)-6-oxidanylidene-4,5-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-[4-(diphenylmethyl)piperazin-1-yl]-4-(3-ethoxy-4-oxidanyl-phenyl)-6-oxidanylidene-4,5-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 2-(4-benzhydrylpiperazin-1-yl)-4-(3-ethoxy-4-hydroxy-phenyl)-6-oxo-4,5-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 2-[4-(diphenylmethyl)-1-piperazinyl]-4-(3-ethoxy-4-hydroxyphenyl)-6-oxo-4,5-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-benzhydrylpiperazin-1-yl)-4-(3-ethoxy-4-hydroxyphenyl)-6-oxo-4,5-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-(4-benzhydrylpiperazino)-4-(3-ethoxy-4-hydroxy-phenyl)-6-keto-4,5-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C32H36N4O5 MolecularWeight: 556.65204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(C(=O)NC(=N2)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)OCC)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2C(C(=O)NC(=N2)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)OCC)O

InChI

InChI=1S/C32H36N4O5/c1-3-40-26-21-24(15-16-25(26)37)28-27(31(39)41-4-2)30(38)34-32(33-28)36-19-17-35(18-20-36)29(22-11-7-5-8-12-22)23-13-9-6-10-14-23/h5-16,21,27-29,37H,3-4,17-20H2,1-2H3,(H,33,34,38)