(3-chloranyl-4,5-dimethoxy-phenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (3-chloranyl-4,5-dimethoxy-phenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (3-chloro-4,5-dimethoxy-phenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: (3-chloro-4,5-dimethoxyphenyl)-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (3-chloro-4,5-dimethoxyphenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (3-chloro-4,5-dimethoxy-phenyl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C17H19ClN4O3 MolecularWeight: 362.81076

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)N2CCN(CC2)C3=NC=CC=N3)Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)N2CCN(CC2)C3=NC=CC=N3)Cl)OC

InChI

InChI=1S/C17H19ClN4O3/c1-24-14-11-12(10-13(18)15(14)25-2)16(23)21-6-8-22(9-7-21)17-19-4-3-5-20-17/h3-5,10-11H,6-9H2,1-2H3