(2-chloranyl-4-fluoranyl-phenyl)-[4-(2-methyl-6-phenoxy-pyrimidin-4-yl)piperazin-1-yl]methanone

Systemtic Name: (2-chloranyl-4-fluoranyl-phenyl)-[4-(2-methyl-6-phenoxy-pyrimidin-4-yl)piperazin-1-yl]methanone Openeye Name: (2-chloro-4-fluoro-phenyl)-[4-(2-methyl-6-phenoxy-pyrimidin-4-yl)piperazin-1-yl]methanone CAS Name: (2-chloro-4-fluorophenyl)-[4-(2-methyl-6-phenoxy-4-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (2-chloro-4-fluorophenyl)-[4-(2-methyl-6-phenoxypyrimidin-4-yl)piperazin-1-yl]methanone Traditional Name: (2-chloro-4-fluoro-phenyl)-[4-(2-methyl-6-phenoxy-pyrimidin-4-yl)piperazino]methanone Formula: C22H20ClFN4O2 MolecularWeight: 426.871203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)OC2=CC=CC=C2)N3CCN(CC3)C(=O)C4=C(C=C(C=C4)F)Cl

Isomeric SMILES

CC1=NC(=CC(=N1)OC2=CC=CC=C2)N3CCN(CC3)C(=O)C4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C22H20ClFN4O2/c1-15-25-20(14-21(26-15)30-17-5-3-2-4-6-17)27-9-11-28(12-10-27)22(29)18-8-7-16(24)13-19(18)23/h2-8,13-14H,9-12H2,1H3