6-[[4-(5-chloranyl-2-methoxy-phenyl)piperazin-1-yl]methyl]-2-piperazin-1-yl-1H-pyrimidin-4-one

Systemtic Name: 6-[[4-(5-chloranyl-2-methoxy-phenyl)piperazin-1-yl]methyl]-2-piperazin-1-yl-1H-pyrimidin-4-one Openeye Name: 6-[[4-(5-chloro-2-methoxy-phenyl)piperazin-1-yl]methyl]-2-piperazin-1-yl-1H-pyrimidin-4-one CAS Name: 6-[[4-(5-chloro-2-methoxyphenyl)-1-piperazinyl]methyl]-2-(1-piperazinyl)-1H-pyrimidin-4-one IUPAC Name: 6-[[4-(5-chloro-2-methoxyphenyl)piperazin-1-yl]methyl]-2-piperazin-1-yl-1H-pyrimidin-4-one Traditional Name: 6-[[4-(5-chloro-2-methoxy-phenyl)piperazino]methyl]-2-piperazino-1H-pyrimidin-4-one Formula: C20H27ClN6O2 MolecularWeight: 418.92038

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)N2CCN(CC2)CC3=CC(=O)N=C(N3)N4CCNCC4

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)N2CCN(CC2)CC3=CC(=O)N=C(N3)N4CCNCC4

InChI

InChI=1S/C20H27ClN6O2/c1-29-18-3-2-15(21)12-17(18)26-10-8-25(9-11-26)14-16-13-19(28)24-20(23-16)27-6-4-22-5-7-27/h2-3,12-13,22H,4-11,14H2,1H3,(H,23,24,28)