4-[2,6-dimethyl-5-[(3-methylphenyl)methyl]pyrimidin-4-yl]-N-(3-fluorophenyl)piperazine-1-carboxamide

Systemtic Name: 4-[2,6-dimethyl-5-[(3-methylphenyl)methyl]pyrimidin-4-yl]-N-(3-fluorophenyl)piperazine-1-carboxamide Openeye Name: 4-[2,6-dimethyl-5-(m-tolylmethyl)pyrimidin-4-yl]-N-(3-fluorophenyl)piperazine-1-carboxamide CAS Name: 4-[2,6-dimethyl-5-[(3-methylphenyl)methyl]-4-pyrimidinyl]-N-(3-fluorophenyl)-1-piperazinecarboxamide IUPAC Name: 4-[2,6-dimethyl-5-[(3-methylphenyl)methyl]pyrimidin-4-yl]-N-(3-fluorophenyl)piperazine-1-carboxamide Traditional Name: 4-[2,6-dimethyl-5-(3-methylbenzyl)pyrimidin-4-yl]-N-(3-fluorophenyl)piperazine-1-carboxamide Formula: C25H28FN5O MolecularWeight: 433.521123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC2=C(N=C(N=C2N3CCN(CC3)C(=O)NC4=CC(=CC=C4)F)C)C

Isomeric SMILES

CC1=CC(=CC=C1)CC2=C(N=C(N=C2N3CCN(CC3)C(=O)NC4=CC(=CC=C4)F)C)C

InChI

InChI=1S/C25H28FN5O/c1-17-6-4-7-20(14-17)15-23-18(2)27-19(3)28-24(23)30-10-12-31(13-11-30)25(32)29-22-9-5-8-21(26)16-22/h4-9,14,16H,10-13,15H2,1-3H3,(H,29,32)