1-[1-(6-bromanylpyridin-2-yl)ethoxymethyl]-4-methyl-benzimidazol-2-amine hydrate

Systemtic Name: 1-[1-(6-bromanylpyridin-2-yl)ethoxymethyl]-4-methyl-benzimidazol-2-amine hydrate Openeye Name: 1-[1-(6-bromo-2-pyridyl)ethoxymethyl]-4-methyl-benzimidazol-2-amine hydrate CAS Name: 1-[1-(6-bromo-2-pyridinyl)ethoxymethyl]-4-methyl-2-benzimidazolamine hydrate IUPAC Name: 1-[1-(6-bromopyridin-2-yl)ethoxymethyl]-4-methylbenzimidazol-2-amine hydrate Traditional Name: [1-[1-(6-bromo-2-pyridyl)ethoxymethyl]-4-methyl-benzimidazol-2-yl]amine hydrate Formula: C16H19BrN4O2 MolecularWeight: 379.25166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N(C(=N2)N)COC(C)C3=NC(=CC=C3)Br.O

Isomeric SMILES

CC1=C2C(=CC=C1)N(C(=N2)N)COC(C)C3=NC(=CC=C3)Br.O

InChI

InChI=1S/C16H17BrN4O.H2O/c1-10-5-3-7-13-15(10)20-16(18)21(13)9-22-11(2)12-6-4-8-14(17)19-12;/h3-8,11H,9H2,1-2H3,(H2,18,20);1H2