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

Systemtic Name: N-(1-phenylethyl)-4-[6-(4-tributylstannyl-1,2,3-triazol-1-yl)benzimidazol-1-yl]pyrimidin-2-amine Openeye Name: N-(1-phenylethyl)-4-[6-(4-tributylstannyltriazol-1-yl)benzimidazol-1-yl]pyrimidin-2-amine CAS Name: N-(1-phenylethyl)-4-[6-(4-tributylstannyl-1-triazolyl)-1-benzimidazolyl]-2-pyrimidinamine IUPAC Name: N-(1-phenylethyl)-4-[6-(4-tributylstannyltriazol-1-yl)benzimidazol-1-yl]pyrimidin-2-amine Traditional Name: 1-phenylethyl-[4-[6-(4-tributylstannyltriazol-1-yl)benzimidazol-1-yl]pyrimidin-2-yl]amine Formula: C33H44N8Sn MolecularWeight: 671.46606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn](CCCC)(CCCC)C1=CN(N=N1)C2=CC3=C(C=C2)N=CN3C4=NC(=NC=C4)NC(C)C5=CC=CC=C5

Isomeric SMILES

CCCC[Sn](CCCC)(CCCC)C1=CN(N=N1)C2=CC3=C(C=C2)N=CN3C4=NC(=NC=C4)NC(C)C5=CC=CC=C5

InChI

InChI=1S/C21H17N8.3C4H9.Sn/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;3*1-3-4-2;/h2-10,12-15H,1H3,(H,22,25,26);3*1,3-4H2,2H3;