N-(4-dimethylphosphorylphenyl)-4-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)pyrimidin-2-amine

Systemtic Name: N-(4-dimethylphosphorylphenyl)-4-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)pyrimidin-2-amine Openeye Name: N-(4-dimethylphosphorylphenyl)-4-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)pyrimidin-2-amine CAS Name: N-(4-dimethylphosphorylphenyl)-4-(4-methyl-1-piperazinyl)-5-(trifluoromethyl)-2-pyrimidinamine IUPAC Name: N-(4-dimethylphosphorylphenyl)-4-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)pyrimidin-2-amine Traditional Name: (4-dimethylphosphorylphenyl)-[4-(4-methylpiperazino)-5-(trifluoromethyl)pyrimidin-2-yl]amine Formula: C18H23F3N5OP MolecularWeight: 413.377091

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC(=NC=C2C(F)(F)F)NC3=CC=C(C=C3)P(=O)(C)C

Isomeric SMILES

CN1CCN(CC1)C2=NC(=NC=C2C(F)(F)F)NC3=CC=C(C=C3)P(=O)(C)C

InChI

InChI=1S/C18H23F3N5OP/c1-25-8-10-26(11-9-25)16-15(18(19,20)21)12-22-17(24-16)23-13-4-6-14(7-5-13)28(2,3)27/h4-7,12H,8-11H2,1-3H3,(H,22,23,24)