N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-N-methyl-2-(4-methylpiperazin-1-yl)-4-naphthalen-1-yl-pyrimidine-5-carboxamide

Systemtic Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-N-methyl-2-(4-methylpiperazin-1-yl)-4-naphthalen-1-yl-pyrimidine-5-carboxamide Openeye Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-N-methyl-2-(4-methylpiperazin-1-yl)-4-(1-naphthyl)pyrimidine-5-carboxamide CAS Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-N-methyl-2-(4-methyl-1-piperazinyl)-4-(1-naphthalenyl)-5-pyrimidinecarboxamide IUPAC Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-N-methyl-2-(4-methylpiperazin-1-yl)-4-naphthalen-1-ylpyrimidine-5-carboxamide Traditional Name: N-[3,5-bis(trifluoromethyl)benzyl]-N-methyl-2-(4-methylpiperazino)-4-(1-naphthyl)pyrimidine-5-carboxamide Formula: C30H27F6N5O MolecularWeight: 587.558699

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=C(C(=N2)C3=CC=CC4=CC=CC=C43)C(=O)N(C)CC5=CC(=CC(=C5)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CN1CCN(CC1)C2=NC=C(C(=N2)C3=CC=CC4=CC=CC=C43)C(=O)N(C)CC5=CC(=CC(=C5)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C30H27F6N5O/c1-39-10-12-41(13-11-39)28-37-17-25(26(38-28)24-9-5-7-20-6-3-4-8-23(20)24)27(42)40(2)18-19-14-21(29(31,32)33)16-22(15-19)30(34,35)36/h3-9,14-17H,10-13,18H2,1-2H3