ethyl 3-ethyl-4-[[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]methyl]-2-oxidanylidene-6-phenyl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 3-ethyl-4-[[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]methyl]-2-oxidanylidene-6-phenyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-ethyl-4-[[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]methyl]-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-ethyl-4-[[4-[(3-methoxyphenyl)methyl]-1-piperazinyl]methyl]-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-ethyl-4-[[4-[(3-methoxyphenyl)methyl]piperazin-1-yl]methyl]-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-ethyl-2-keto-4-[(4-m-anisylpiperazino)methyl]-6-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C28H36N4O4 MolecularWeight: 492.60984

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=O)C2=CC=CC=C2)C(=O)OCC)CN3CCN(CC3)CC4=CC(=CC=C4)OC

Isomeric SMILES

CCN1C(=C(C(NC1=O)C2=CC=CC=C2)C(=O)OCC)CN3CCN(CC3)CC4=CC(=CC=C4)OC

InChI

InChI=1S/C28H36N4O4/c1-4-32-24(20-31-16-14-30(15-17-31)19-21-10-9-13-23(18-21)35-3)25(27(33)36-5-2)26(29-28(32)34)22-11-7-6-8-12-22/h6-13,18,26H,4-5,14-17,19-20H2,1-3H3,(H,29,34)