3,5-bis[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-1,2-oxazole dihydrochloride

Systemtic Name: 3,5-bis[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-1,2-oxazole dihydrochloride Openeye Name: 3,5-bis[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]isoxazole dihydrochloride CAS Name: 3,5-bis[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]isoxazole dihydrochloride IUPAC Name: 3,5-bis[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-1,2-oxazole dihydrochloride Traditional Name: 3,5-bis[3-(2-imidazolin-2-yl)phenyl]isoxazole dihydrochloride Formula: C21H21Cl2N5O MolecularWeight: 430.33034

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(N1)C2=CC=CC(=C2)C3=CC(=NO3)C4=CC(=CC=C4)C5=NCCN5.Cl.Cl

Isomeric SMILES

C1CN=C(N1)C2=CC=CC(=C2)C3=CC(=NO3)C4=CC(=CC=C4)C5=NCCN5.Cl.Cl

InChI

InChI=1S/C21H19N5O.2ClH/c1-3-14(11-16(5-1)20-22-7-8-23-20)18-13-19(27-26-18)15-4-2-6-17(12-15)21-24-9-10-25-21;;/h1-6,11-13H,7-10H2,(H,22,23)(H,24,25);2*1H