4-[(1-pyridin-2-ylpyrrolidin-2-yl)methyl]quinazoline-2-carboxamide trihydrochloride

Systemtic Name: 4-[(1-pyridin-2-ylpyrrolidin-2-yl)methyl]quinazoline-2-carboxamide trihydrochloride Openeye Name: 4-[[1-(2-pyridyl)pyrrolidin-2-yl]methyl]quinazoline-2-carboxamide trihydrochloride CAS Name: 4-[[1-(2-pyridinyl)-2-pyrrolidinyl]methyl]-2-quinazolinecarboxamide trihydrochloride IUPAC Name: 4-[(1-pyridin-2-ylpyrrolidin-2-yl)methyl]quinazoline-2-carboxamide trihydrochloride Traditional Name: 4-[[1-(2-pyridyl)pyrrolidin-2-yl]methyl]quinazoline-2-carboxamide trihydrochloride Formula: C19H22Cl3N5O MolecularWeight: 442.76988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=CC=CC=N2)CC3=NC(=NC4=CC=CC=C43)C(=O)N.Cl.Cl.Cl

Isomeric SMILES

C1CC(N(C1)C2=CC=CC=N2)CC3=NC(=NC4=CC=CC=C43)C(=O)N.Cl.Cl.Cl

InChI

InChI=1S/C19H19N5O.3ClH/c20-18(25)19-22-15-8-2-1-7-14(15)16(23-19)12-13-6-5-11-24(13)17-9-3-4-10-21-17;;;/h1-4,7-10,13H,5-6,11-12H2,(H2,20,25);3*1H