6-methyl-5-piperidin-4-yl-3-[4-(trifluoromethyl)phenyl]-4H-pyrimidine-2,4-diamine

Systemtic Name: 6-methyl-5-piperidin-4-yl-3-[4-(trifluoromethyl)phenyl]-4H-pyrimidine-2,4-diamine Openeye Name: 6-methyl-5-(4-piperidyl)-3-[4-(trifluoromethyl)phenyl]-4H-pyrimidine-2,4-diamine CAS Name: 6-methyl-5-(4-piperidinyl)-3-[4-(trifluoromethyl)phenyl]-4H-pyrimidine-2,4-diamine IUPAC Name: 6-methyl-5-piperidin-4-yl-3-[4-(trifluoromethyl)phenyl]-4H-pyrimidine-2,4-diamine Traditional Name: [2-amino-6-methyl-5-(4-piperidyl)-3-[4-(trifluoromethyl)phenyl]-4H-pyrimidin-4-yl]amine Formula: C17H22F3N5 MolecularWeight: 353.38529

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(C(=N1)N)C2=CC=C(C=C2)C(F)(F)F)N)C3CCNCC3

Isomeric SMILES

CC1=C(C(N(C(=N1)N)C2=CC=C(C=C2)C(F)(F)F)N)C3CCNCC3

InChI

InChI=1S/C17H22F3N5/c1-10-14(11-6-8-23-9-7-11)15(21)25(16(22)24-10)13-4-2-12(3-5-13)17(18,19)20/h2-5,11,15,23H,6-9,21H2,1H3,(H2,22,24)