N-(azepan-4-yl)-3-(furan-2-ylmethyl)imidazo[4,5-b]pyridin-2-amine dihydrochloride

Systemtic Name: N-(azepan-4-yl)-3-(furan-2-ylmethyl)imidazo[4,5-b]pyridin-2-amine dihydrochloride Openeye Name: N-(azepan-4-yl)-3-(2-furylmethyl)imidazo[4,5-b]pyridin-2-amine dihydrochloride CAS Name: N-(4-azepanyl)-3-(2-furanylmethyl)-2-imidazo[4,5-b]pyridinamine dihydrochloride IUPAC Name: N-(azepan-4-yl)-3-(furan-2-ylmethyl)imidazo[4,5-b]pyridin-2-amine dihydrochloride Traditional Name: azepan-4-yl-[3-(2-furfuryl)imidazo[4,5-b]pyridin-2-yl]amine dihydrochloride Formula: C17H23Cl2N5O MolecularWeight: 384.30342

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCNC1)NC2=NC3=C(N2CC4=CC=CO4)N=CC=C3.Cl.Cl

Isomeric SMILES

C1CC(CCNC1)NC2=NC3=C(N2CC4=CC=CO4)N=CC=C3.Cl.Cl

InChI

InChI=1S/C17H21N5O.2ClH/c1-4-13(7-10-18-8-1)20-17-21-15-6-2-9-19-16(15)22(17)12-14-5-3-11-23-14;;/h2-3,5-6,9,11,13,18H,1,4,7-8,10,12H2,(H,20,21);2*1H