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

Systemtic Name: ethyl 6-(3-fluorophenyl)-2-oxidanylidene-4-[(4-propanoylpiperazin-1-yl)methyl]-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-allyl-6-(3-fluorophenyl)-2-oxo-4-[(4-propanoylpiperazin-1-yl)methyl]-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(3-fluorophenyl)-2-oxo-4-[[4-(1-oxopropyl)-1-piperazinyl]methyl]-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(3-fluorophenyl)-2-oxo-4-[(4-propanoylpiperazin-1-yl)methyl]-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-allyl-6-(3-fluorophenyl)-2-keto-4-[(4-propionylpiperazino)methyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C24H31FN4O4 MolecularWeight: 458.525743

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)CC2=C(C(NC(=O)N2CC=C)C3=CC(=CC=C3)F)C(=O)OCC

Isomeric SMILES

CCC(=O)N1CCN(CC1)CC2=C(C(NC(=O)N2CC=C)C3=CC(=CC=C3)F)C(=O)OCC

InChI

InChI=1S/C24H31FN4O4/c1-4-10-29-19(16-27-11-13-28(14-12-27)20(30)5-2)21(23(31)33-6-3)22(26-24(29)32)17-8-7-9-18(25)15-17/h4,7-9,15,22H,1,5-6,10-14,16H2,2-3H3,(H,26,32)