N-(5-chloranyl-2-methoxy-phenyl)-6-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)-4,5-dihydro-1H-pyrimidine-4-carboxamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-6-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)-4,5-dihydro-1H-pyrimidine-4-carboxamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-6-oxo-2-[4-(2-pyridyl)piperazin-1-yl]-4,5-dihydro-1H-pyrimidine-4-carboxamide CAS Name: N-(5-chloro-2-methoxyphenyl)-6-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]-4,5-dihydro-1H-pyrimidine-4-carboxamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-6-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)-4,5-dihydro-1H-pyrimidine-4-carboxamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-6-keto-2-[4-(2-pyridyl)piperazino]-4,5-dihydro-1H-pyrimidine-4-carboxamide Formula: C21H23ClN6O3 MolecularWeight: 442.89872

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)C2CC(=O)NC(=N2)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)C2CC(=O)NC(=N2)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C21H23ClN6O3/c1-31-17-6-5-14(22)12-15(17)24-20(30)16-13-19(29)26-21(25-16)28-10-8-27(9-11-28)18-4-2-3-7-23-18/h2-7,12,16H,8-11,13H2,1H3,(H,24,30)(H,25,26,29)