ethyl 6-(4-methylphenyl)-4-[[4-(2-methylpropanoyl)piperazin-1-yl]methyl]-2-oxidanylidene-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 6-(4-methylphenyl)-4-[[4-(2-methylpropanoyl)piperazin-1-yl]methyl]-2-oxidanylidene-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-allyl-4-[[4-(2-methylpropanoyl)piperazin-1-yl]methyl]-2-oxo-6-(p-tolyl)-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-[[4-(2-methyl-1-oxopropyl)-1-piperazinyl]methyl]-6-(4-methylphenyl)-2-oxo-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(4-methylphenyl)-4-[[4-(2-methylpropanoyl)piperazin-1-yl]methyl]-2-oxo-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-allyl-4-[(4-isobutyrylpiperazino)methyl]-2-keto-6-(p-tolyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C26H36N4O4 MolecularWeight: 468.58844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H36N4O4/c1-6-12-30-21(17-28-13-15-29(16-14-28)24(31)18(3)4)22(25(32)34-7-2)23(27-26(30)33)20-10-8-19(5)9-11-20/h6,8-11,18,23H,1,7,12-17H2,2-5H3,(H,27,33)