6-methyl-2-pyridin-3-yl-4,4-bis(trifluoromethyl)-1H-pyrimidine-5-carbonitrile

Systemtic Name: 6-methyl-2-pyridin-3-yl-4,4-bis(trifluoromethyl)-1H-pyrimidine-5-carbonitrile Openeye Name: 6-methyl-2-(3-pyridyl)-4,4-bis(trifluoromethyl)-1H-pyrimidine-5-carbonitrile CAS Name: 6-methyl-2-(3-pyridinyl)-4,4-bis(trifluoromethyl)-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-methyl-2-pyridin-3-yl-4,4-bis(trifluoromethyl)-1H-pyrimidine-5-carbonitrile Traditional Name: 6-methyl-2-(3-pyridyl)-4,4-bis(trifluoromethyl)-1H-pyrimidine-5-carbonitrile Formula: C13H8F6N4 MolecularWeight: 334.219839

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N=C(N1)C2=CN=CC=C2)(C(F)(F)F)C(F)(F)F)C#N

Isomeric SMILES

CC1=C(C(N=C(N1)C2=CN=CC=C2)(C(F)(F)F)C(F)(F)F)C#N

InChI

InChI=1S/C13H8F6N4/c1-7-9(5-20)11(12(14,15)16,13(17,18)19)23-10(22-7)8-3-2-4-21-6-8/h2-4,6H,1H3,(H,22,23)