4-[3-(4-ethoxyphenyl)-5-(trifluoromethyl)pyrazol-1-yl]-6-methyl-pyrimidin-2-amine

Systemtic Name: 4-[3-(4-ethoxyphenyl)-5-(trifluoromethyl)pyrazol-1-yl]-6-methyl-pyrimidin-2-amine Openeye Name: 4-[3-(4-ethoxyphenyl)-5-(trifluoromethyl)pyrazol-1-yl]-6-methyl-pyrimidin-2-amine CAS Name: 4-[3-(4-ethoxyphenyl)-5-(trifluoromethyl)-1-pyrazolyl]-6-methyl-2-pyrimidinamine IUPAC Name: 4-[3-(4-ethoxyphenyl)-5-(trifluoromethyl)pyrazol-1-yl]-6-methylpyrimidin-2-amine Traditional Name: [4-methyl-6-[3-p-phenetyl-5-(trifluoromethyl)pyrazol-1-yl]pyrimidin-2-yl]amine Formula: C17H16F3N5O MolecularWeight: 363.33705

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN(C(=C2)C(F)(F)F)C3=NC(=NC(=C3)C)N

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN(C(=C2)C(F)(F)F)C3=NC(=NC(=C3)C)N

InChI

InChI=1S/C17H16F3N5O/c1-3-26-12-6-4-11(5-7-12)13-9-14(17(18,19)20)25(24-13)15-8-10(2)22-16(21)23-15/h4-9H,3H2,1-2H3,(H2,21,22,23)