methyl 6-oxidanylidene-4-phenyl-2-(4-pyridin-2-ylpiperazin-1-yl)-4,5-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl 6-oxidanylidene-4-phenyl-2-(4-pyridin-2-ylpiperazin-1-yl)-4,5-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl 6-oxo-4-phenyl-2-[4-(2-pyridyl)piperazin-1-yl]-4,5-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-oxo-4-phenyl-2-[4-(2-pyridinyl)-1-piperazinyl]-4,5-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 6-oxo-4-phenyl-2-(4-pyridin-2-ylpiperazin-1-yl)-4,5-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-keto-4-phenyl-2-[4-(2-pyridyl)piperazino]-4,5-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C21H23N5O3 MolecularWeight: 393.43902

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(N=C(NC1=O)N2CCN(CC2)C3=CC=CC=N3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1C(N=C(NC1=O)N2CCN(CC2)C3=CC=CC=N3)C4=CC=CC=C4

InChI

InChI=1S/C21H23N5O3/c1-29-20(28)17-18(15-7-3-2-4-8-15)23-21(24-19(17)27)26-13-11-25(12-14-26)16-9-5-6-10-22-16/h2-10,17-18H,11-14H2,1H3,(H,23,24,27)