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

Systemtic Name: ethyl 4-[[4-(3-methoxyphenyl)carbonylpiperazin-1-yl]methyl]-2-oxidanylidene-6-phenyl-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-allyl-4-[[4-(3-methoxybenzoyl)piperazin-1-yl]methyl]-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-[[4-[(3-methoxyphenyl)-oxomethyl]-1-piperazinyl]methyl]-2-oxo-6-phenyl-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[[4-(3-methoxybenzoyl)piperazin-1-yl]methyl]-2-oxo-6-phenyl-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-allyl-2-keto-4-[(4-m-anisoylpiperazino)methyl]-6-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C29H34N4O5 MolecularWeight: 518.60406

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=CC=CC=C2)CC=C)CN3CCN(CC3)C(=O)C4=CC(=CC=C4)OC

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)NC1C2=CC=CC=C2)CC=C)CN3CCN(CC3)C(=O)C4=CC(=CC=C4)OC

InChI

InChI=1S/C29H34N4O5/c1-4-14-33-24(25(28(35)38-5-2)26(30-29(33)36)21-10-7-6-8-11-21)20-31-15-17-32(18-16-31)27(34)22-12-9-13-23(19-22)37-3/h4,6-13,19,26H,1,5,14-18,20H2,2-3H3,(H,30,36)