N-(3-fluoranyl-4-methyl-phenyl)-4-(2-methyl-6-phenoxy-pyrimidin-4-yl)piperazine-1-carboxamide

Systemtic Name: N-(3-fluoranyl-4-methyl-phenyl)-4-(2-methyl-6-phenoxy-pyrimidin-4-yl)piperazine-1-carboxamide Openeye Name: N-(3-fluoro-4-methyl-phenyl)-4-(2-methyl-6-phenoxy-pyrimidin-4-yl)piperazine-1-carboxamide CAS Name: N-(3-fluoro-4-methylphenyl)-4-(2-methyl-6-phenoxy-4-pyrimidinyl)-1-piperazinecarboxamide IUPAC Name: N-(3-fluoro-4-methylphenyl)-4-(2-methyl-6-phenoxypyrimidin-4-yl)piperazine-1-carboxamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-4-(2-methyl-6-phenoxy-pyrimidin-4-yl)piperazine-1-carboxamide Formula: C23H24FN5O2 MolecularWeight: 421.467363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)C3=CC(=NC(=N3)C)OC4=CC=CC=C4)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)C3=CC(=NC(=N3)C)OC4=CC=CC=C4)F

InChI

InChI=1S/C23H24FN5O2/c1-16-8-9-18(14-20(16)24)27-23(30)29-12-10-28(11-13-29)21-15-22(26-17(2)25-21)31-19-6-4-3-5-7-19/h3-9,14-15H,10-13H2,1-2H3,(H,27,30)