N4-[6-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]-1H-benzimidazole-2,4-diamine

Systemtic Name: N4-[6-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]-1H-benzimidazole-2,4-diamine Openeye Name: N4-[6-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]-1H-benzimidazole-2,4-diamine CAS Name: N4-[6-[4-(trifluoromethyl)phenyl]-4-pyrimidinyl]-1H-benzimidazole-2,4-diamine IUPAC Name: 4-N-[6-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]-1H-benzimidazole-2,4-diamine Traditional Name: (2-amino-1H-benzimidazol-4-yl)-[6-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]amine Formula: C18H13F3N6 MolecularWeight: 370.33123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)NC3=NC=NC(=C3)C4=CC=C(C=C4)C(F)(F)F)N=C(N2)N

Isomeric SMILES

C1=CC2=C(C(=C1)NC3=NC=NC(=C3)C4=CC=C(C=C4)C(F)(F)F)N=C(N2)N

InChI

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