4-methyl-2-[[2-pyridin-3-yl-6-(trifluoromethyl)pyrimidin-4-yl]amino]benzenecarbonitrile

Systemtic Name: 4-methyl-2-[[2-pyridin-3-yl-6-(trifluoromethyl)pyrimidin-4-yl]amino]benzenecarbonitrile Openeye Name: 4-methyl-2-[[2-(3-pyridyl)-6-(trifluoromethyl)pyrimidin-4-yl]amino]benzonitrile CAS Name: 4-methyl-2-[[2-(3-pyridinyl)-6-(trifluoromethyl)-4-pyrimidinyl]amino]benzonitrile IUPAC Name: 4-methyl-2-[[2-pyridin-3-yl-6-(trifluoromethyl)pyrimidin-4-yl]amino]benzonitrile Traditional Name: 4-methyl-2-[[2-(3-pyridyl)-6-(trifluoromethyl)pyrimidin-4-yl]amino]benzonitrile Formula: C18H12F3N5 MolecularWeight: 355.31659

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C#N)NC2=NC(=NC(=C2)C(F)(F)F)C3=CN=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C#N)NC2=NC(=NC(=C2)C(F)(F)F)C3=CN=CC=C3

InChI

InChI=1S/C18H12F3N5/c1-11-4-5-12(9-22)14(7-11)24-16-8-15(18(19,20)21)25-17(26-16)13-3-2-6-23-10-13/h2-8,10H,1H3,(H,24,25,26)