2-azanyl-4-pyridin-2-yl-6-[[4-(trifluoromethyl)phenyl]methylamino]pyrimidine-5-carbonitrile

Systemtic Name: 2-azanyl-4-pyridin-2-yl-6-[[4-(trifluoromethyl)phenyl]methylamino]pyrimidine-5-carbonitrile Openeye Name: 2-amino-4-(2-pyridyl)-6-[[4-(trifluoromethyl)phenyl]methylamino]pyrimidine-5-carbonitrile CAS Name: 2-amino-4-(2-pyridinyl)-6-[[4-(trifluoromethyl)phenyl]methylamino]-5-pyrimidinecarbonitrile IUPAC Name: 2-amino-4-pyridin-2-yl-6-[[4-(trifluoromethyl)phenyl]methylamino]pyrimidine-5-carbonitrile Traditional Name: 2-amino-4-(2-pyridyl)-6-[[4-(trifluoromethyl)benzyl]amino]pyrimidine-5-carbonitrile Formula: C18H13F3N6 MolecularWeight: 370.33123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=C(C(=NC(=N2)N)NCC3=CC=C(C=C3)C(F)(F)F)C#N

Isomeric SMILES

C1=CC=NC(=C1)C2=C(C(=NC(=N2)N)NCC3=CC=C(C=C3)C(F)(F)F)C#N

InChI

InChI=1S/C18H13F3N6/c19-18(20,21)12-6-4-11(5-7-12)10-25-16-13(9-22)15(26-17(23)27-16)14-3-1-2-8-24-14/h1-8H,10H2,(H3,23,25,26,27)