ethyl 2-oxidanylidene-4-phenyl-6-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-oxidanylidene-4-phenyl-6-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[4-[(E)-cinnamyl]piperazin-1-yl]methyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 2-oxo-4-phenyl-6-[[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-oxo-4-phenyl-6-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[[4-[(E)-cinnamyl]piperazino]methyl]-2-keto-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C27H32N4O3 MolecularWeight: 460.56798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)CN3CCN(CC3)CC=CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)CN3CCN(CC3)C/C=C/C4=CC=CC=C4

InChI

InChI=1S/C27H32N4O3/c1-2-34-26(32)24-23(28-27(33)29-25(24)22-13-7-4-8-14-22)20-31-18-16-30(17-19-31)15-9-12-21-10-5-3-6-11-21/h3-14,25H,2,15-20H2,1H3,(H2,28,29,33)/b12-9+