6-(1,2-dimethylimidazol-4-yl)-4-methyl-1-[[3-phenyl-2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]methyl]-2-propyl-benzimidazole hydrate

Systemtic Name: 6-(1,2-dimethylimidazol-4-yl)-4-methyl-1-[[3-phenyl-2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]methyl]-2-propyl-benzimidazole hydrate Openeye Name: 6-(1,2-dimethylimidazol-4-yl)-4-methyl-1-[[3-phenyl-2-(2H-tetrazol-5-yl)phenyl]methyl]-2-propyl-benzimidazole hydrate CAS Name: 6-(1,2-dimethyl-4-imidazolyl)-4-methyl-1-[[3-phenyl-2-(2H-tetrazol-5-yl)phenyl]methyl]-2-propylbenzimidazole hydrate IUPAC Name: 6-(1,2-dimethylimidazol-4-yl)-4-methyl-1-[[3-phenyl-2-(2H-tetrazol-5-yl)phenyl]methyl]-2-propylbenzimidazole hydrate Traditional Name: 6-(1,2-dimethylimidazol-4-yl)-4-methyl-1-[3-phenyl-2-(2H-tetrazol-5-yl)benzyl]-2-propyl-benzimidazole hydrate Formula: C30H32N8O MolecularWeight: 520.62808

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=C(C=C2N1CC3=CC=CC(=C3C4=NNN=N4)C5=CC=CC=C5)C6=CN(C(=N6)C)C)C.O

Isomeric SMILES

CCCC1=NC2=C(C=C(C=C2N1CC3=CC=CC(=C3C4=NNN=N4)C5=CC=CC=C5)C6=CN(C(=N6)C)C)C.O

InChI

InChI=1S/C30H30N8.H2O/c1-5-10-27-32-29-19(2)15-23(25-18-37(4)20(3)31-25)16-26(29)38(27)17-22-13-9-14-24(21-11-7-6-8-12-21)28(22)30-33-35-36-34-30;/h6-9,11-16,18H,5,10,17H2,1-4H3,(H,33,34,35,36);1H2