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

Systemtic Name: ethyl 4-[[4-(4-methoxyphenyl)carbonylpiperazin-1-yl]methyl]-6-(2-methylphenyl)-2-oxidanylidene-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-allyl-4-[[4-(4-methoxybenzoyl)piperazin-1-yl]methyl]-6-(o-tolyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-[[4-[(4-methoxyphenyl)-oxomethyl]-1-piperazinyl]methyl]-6-(2-methylphenyl)-2-oxo-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[[4-(4-methoxybenzoyl)piperazin-1-yl]methyl]-6-(2-methylphenyl)-2-oxo-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-allyl-2-keto-6-(o-tolyl)-4-[(4-p-anisoylpiperazino)methyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C30H36N4O5 MolecularWeight: 532.63064

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=CC=CC=C2C)CC=C)CN3CCN(CC3)C(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)NC1C2=CC=CC=C2C)CC=C)CN3CCN(CC3)C(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C30H36N4O5/c1-5-15-34-25(20-32-16-18-33(19-17-32)28(35)22-11-13-23(38-4)14-12-22)26(29(36)39-6-2)27(31-30(34)37)24-10-8-7-9-21(24)3/h5,7-14,27H,1,6,15-20H2,2-4H3,(H,31,37)