2-ethyl-5,7-dimethyl-3-(2-methyl-1H-benzimidazol-4-yl)imidazo[4,5-b]pyridine trihydrate

Systemtic Name: 2-ethyl-5,7-dimethyl-3-(2-methyl-1H-benzimidazol-4-yl)imidazo[4,5-b]pyridine trihydrate Openeye Name: 2-ethyl-5,7-dimethyl-3-(2-methyl-1H-benzimidazol-4-yl)imidazo[4,5-b]pyridine trihydrate CAS Name: 2-ethyl-5,7-dimethyl-3-(2-methyl-1H-benzimidazol-4-yl)imidazo[4,5-b]pyridine trihydrate IUPAC Name: 2-ethyl-5,7-dimethyl-3-(2-methyl-1H-benzimidazol-4-yl)imidazo[4,5-b]pyridine trihydrate Traditional Name: 2-ethyl-5,7-dimethyl-3-(2-methyl-1H-benzimidazol-4-yl)imidazo[4,5-b]pyridine trihydrate Formula: C18H25N5O3 MolecularWeight: 359.4228

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1C3=CC=CC4=C3N=C(N4)C)N=C(C=C2C)C.O.O.O

Isomeric SMILES

CCC1=NC2=C(N1C3=CC=CC4=C3N=C(N4)C)N=C(C=C2C)C.O.O.O

InChI

InChI=1S/C18H19N5.3H2O/c1-5-15-22-16-10(2)9-11(3)19-18(16)23(15)14-8-6-7-13-17(14)21-12(4)20-13;;;/h6-9H,5H2,1-4H3,(H,20,21);3*1H2