N-(1-phenylethyl)-4-[6-(4-phenyl-1,2,3-triazol-1-yl)benzimidazol-1-yl]pyrimidin-2-amine

Systemtic Name: N-(1-phenylethyl)-4-[6-(4-phenyl-1,2,3-triazol-1-yl)benzimidazol-1-yl]pyrimidin-2-amine Openeye Name: N-(1-phenylethyl)-4-[6-(4-phenyltriazol-1-yl)benzimidazol-1-yl]pyrimidin-2-amine CAS Name: N-(1-phenylethyl)-4-[6-(4-phenyl-1-triazolyl)-1-benzimidazolyl]-2-pyrimidinamine IUPAC Name: N-(1-phenylethyl)-4-[6-(4-phenyltriazol-1-yl)benzimidazol-1-yl]pyrimidin-2-amine Traditional Name: 1-phenylethyl-[4-[6-(4-phenyltriazol-1-yl)benzimidazol-1-yl]pyrimidin-2-yl]amine Formula: C27H22N8 MolecularWeight: 458.51718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=C(C=C4)N5C=C(N=N5)C6=CC=CC=C6

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=C(C=C4)N5C=C(N=N5)C6=CC=CC=C6

InChI

InChI=1S/C27H22N8/c1-19(20-8-4-2-5-9-20)30-27-28-15-14-26(31-27)34-18-29-23-13-12-22(16-25(23)34)35-17-24(32-33-35)21-10-6-3-7-11-21/h2-19H,1H3,(H,28,30,31)