1-[2-(1-phenylethylamino)pyrimidin-4-yl]-4-(trifluoromethyl)benzimidazol-5-amine

Systemtic Name: 1-[2-(1-phenylethylamino)pyrimidin-4-yl]-4-(trifluoromethyl)benzimidazol-5-amine Openeye Name: 1-[2-(1-phenylethylamino)pyrimidin-4-yl]-4-(trifluoromethyl)benzimidazol-5-amine CAS Name: 1-[2-(1-phenylethylamino)-4-pyrimidinyl]-4-(trifluoromethyl)-5-benzimidazolamine IUPAC Name: 1-[2-(1-phenylethylamino)pyrimidin-4-yl]-4-(trifluoromethyl)benzimidazol-5-amine Traditional Name: [4-[5-amino-4-(trifluoromethyl)benzimidazol-1-yl]pyrimidin-2-yl]-(1-phenylethyl)amine Formula: C20H17F3N6 MolecularWeight: 398.38439

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4C(F)(F)F)N

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4C(F)(F)F)N

InChI

InChI=1S/C20H17F3N6/c1-12(13-5-3-2-4-6-13)27-19-25-10-9-16(28-19)29-11-26-18-15(29)8-7-14(24)17(18)20(21,22)23/h2-12H,24H2,1H3,(H,25,27,28)