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

Systemtic Name: N-(1-phenylethyl)-4-[6-(1,2,3-triazol-1-yl)benzimidazol-1-yl]pyrimidin-2-amine Openeye Name: N-(1-phenylethyl)-4-[6-(triazol-1-yl)benzimidazol-1-yl]pyrimidin-2-amine CAS Name: N-(1-phenylethyl)-4-[6-(1-triazolyl)-1-benzimidazolyl]-2-pyrimidinamine IUPAC Name: N-(1-phenylethyl)-4-[6-(triazol-1-yl)benzimidazol-1-yl]pyrimidin-2-amine Traditional Name: 1-phenylethyl-[4-[6-(triazol-1-yl)benzimidazol-1-yl]pyrimidin-2-yl]amine Formula: C21H18N8 MolecularWeight: 382.42122

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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=CN=N5

Isomeric SMILES

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

InChI

InChI=1S/C21H18N8/c1-15(16-5-3-2-4-6-16)25-21-22-10-9-20(26-21)28-14-23-18-8-7-17(13-19(18)28)29-12-11-24-27-29/h2-15H,1H3,(H,22,25,26)