N-[(1S)-1-[5-(4-methoxyquinolin-2-yl)-1H-imidazol-2-yl]-7-oxidanylidene-nonyl]-1-methyl-azetidine-3-carboxamide trihydrochloride

Systemtic Name: N-[(1S)-1-[5-(4-methoxyquinolin-2-yl)-1H-imidazol-2-yl]-7-oxidanylidene-nonyl]-1-methyl-azetidine-3-carboxamide trihydrochloride Openeye Name: N-[(1S)-1-[5-(4-methoxy-2-quinolyl)-1H-imidazol-2-yl]-7-oxo-nonyl]-1-methyl-azetidine-3-carboxamide trihydrochloride CAS Name: N-[(1S)-1-[5-(4-methoxy-2-quinolinyl)-1H-imidazol-2-yl]-7-oxononyl]-1-methyl-3-azetidinecarboxamide trihydrochloride IUPAC Name: N-[(1S)-1-[5-(4-methoxyquinolin-2-yl)-1H-imidazol-2-yl]-7-oxononyl]-1-methylazetidine-3-carboxamide trihydrochloride Traditional Name: N-[(1S)-7-keto-1-[5-(4-methoxy-2-quinolyl)-1H-imidazol-2-yl]nonyl]-1-methyl-azetidine-3-carboxamide trihydrochloride Formula: C27H38Cl3N5O3 MolecularWeight: 586.98132

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CCCCCC(C1=NC=C(N1)C2=NC3=CC=CC=C3C(=C2)OC)NC(=O)C4CN(C4)C.Cl.Cl.Cl

Isomeric SMILES

CCC(=O)CCCCC[C@@H](C1=NC=C(N1)C2=NC3=CC=CC=C3C(=C2)OC)NC(=O)C4CN(C4)C.Cl.Cl.Cl

InChI

InChI=1S/C27H35N5O3.3ClH/c1-4-19(33)10-6-5-7-13-22(31-27(34)18-16-32(2)17-18)26-28-15-24(30-26)23-14-25(35-3)20-11-8-9-12-21(20)29-23;;;/h8-9,11-12,14-15,18,22H,4-7,10,13,16-17H2,1-3H3,(H,28,30)(H,31,34);3*1H/t22-;;;/m0.../s1