3-(2-dimethylaminoethylamino)-6-pyridin-4-yl-1H-imidazo[4,5-b]pyridin-2-one; methanesulfonic acid

Systemtic Name: 3-(2-dimethylaminoethylamino)-6-pyridin-4-yl-1H-imidazo[4,5-b]pyridin-2-one; methanesulfonic acid Openeye Name: 3-(2-dimethylaminoethylamino)-6-(4-pyridyl)-1H-imidazo[4,5-b]pyridin-2-one; methanesulfonic acid CAS Name: 3-(2-dimethylaminoethylamino)-6-pyridin-4-yl-1H-imidazo[4,5-b]pyridin-2-one; methanesulfonic acid IUPAC Name: 3-(2-dimethylaminoethylamino)-6-pyridin-4-yl-1H-imidazo[4,5-b]pyridin-2-one; methanesulfonic acid Traditional Name: 3-(2-dimethylaminoethylamino)-6-(4-pyridyl)-1H-imidazo[4,5-b]pyridin-2-one; mesylic acid Formula: C17H26N6O7S2 MolecularWeight: 490.55434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNN1C2=C(C=C(C=N2)C3=CC=NC=C3)NC1=O.CS(=O)(=O)O.CS(=O)(=O)O

Isomeric SMILES

CN(C)CCNN1C2=C(C=C(C=N2)C3=CC=NC=C3)NC1=O.CS(=O)(=O)O.CS(=O)(=O)O

InChI

InChI=1S/C15H18N6O.2CH4O3S/c1-20(2)8-7-18-21-14-13(19-15(21)22)9-12(10-17-14)11-3-5-16-6-4-11;2*1-5(2,3)4/h3-6,9-10,18H,7-8H2,1-2H3,(H,19,22);2*1H3,(H,2,3,4)