ethanedioate; N-(1-methylazepan-4-yl)-3-[(5-methylfuran-2-yl)methyl]imidazo[4,5-b]pyridin-2-amine

Systemtic Name: ethanedioate; N-(1-methylazepan-4-yl)-3-[(5-methylfuran-2-yl)methyl]imidazo[4,5-b]pyridin-2-amine Openeye Name: N-(1-methylazepan-4-yl)-3-[(5-methyl-2-furyl)methyl]imidazo[4,5-b]pyridin-2-amine; oxalate CAS Name: N-(1-methyl-4-azepanyl)-3-[(5-methyl-2-furanyl)methyl]-2-imidazo[4,5-b]pyridinamine; oxalate IUPAC Name: N-(1-methylazepan-4-yl)-3-[(5-methylfuran-2-yl)methyl]imidazo[4,5-b]pyridin-2-amine; oxalate Traditional Name: (1-methylazepan-4-yl)-[3-[(5-methyl-2-furyl)methyl]imidazo[4,5-b]pyridin-2-yl]amine; oxalate Formula: C23H25N5O9-4 MolecularWeight: 515.4727

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN2C3=C(C=CC=N3)N=C2NC4CCCN(CC4)C.C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-]

Isomeric SMILES

CC1=CC=C(O1)CN2C3=C(C=CC=N3)N=C2NC4CCCN(CC4)C.C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-]

InChI

InChI=1S/C19H25N5O.2C2H2O4/c1-14-7-8-16(25-14)13-24-18-17(6-3-10-20-18)22-19(24)21-15-5-4-11-23(2)12-9-15;2*3-1(4)2(5)6/h3,6-8,10,15H,4-5,9,11-13H2,1-2H3,(H,21,22);2*(H,3,4)(H,5,6)/p-4