4-[(4-bromophenyl)amino]-6-methyl-2-(trifluoromethyl)pyrimidine-5-carbonitrile

Systemtic Name: 4-[(4-bromophenyl)amino]-6-methyl-2-(trifluoromethyl)pyrimidine-5-carbonitrile Openeye Name: 4-(4-bromoanilino)-6-methyl-2-(trifluoromethyl)pyrimidine-5-carbonitrile CAS Name: 4-(4-bromoanilino)-6-methyl-2-(trifluoromethyl)-5-pyrimidinecarbonitrile IUPAC Name: 4-(4-bromoanilino)-6-methyl-2-(trifluoromethyl)pyrimidine-5-carbonitrile Traditional Name: 4-(4-bromoanilino)-6-methyl-2-(trifluoromethyl)pyrimidine-5-carbonitrile Formula: C13H8BrF3N4 MolecularWeight: 357.12863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C(F)(F)F)NC2=CC=C(C=C2)Br)C#N

Isomeric SMILES

CC1=C(C(=NC(=N1)C(F)(F)F)NC2=CC=C(C=C2)Br)C#N

InChI

InChI=1S/C13H8BrF3N4/c1-7-10(6-18)11(21-12(19-7)13(15,16)17)20-9-4-2-8(14)3-5-9/h2-5H,1H3,(H,19,20,21)