N-[3-(4-methylimidazol-1-yl)phenyl]-5,6-dihydrobenzo[h]quinazolin-4-amine dihydrochloride

Systemtic Name: N-[3-(4-methylimidazol-1-yl)phenyl]-5,6-dihydrobenzo[h]quinazolin-4-amine dihydrochloride Openeye Name: N-[3-(4-methylimidazol-1-yl)phenyl]-5,6-dihydrobenzo[h]quinazolin-4-amine dihydrochloride CAS Name: N-[3-(4-methyl-1-imidazolyl)phenyl]-5,6-dihydrobenzo[h]quinazolin-4-amine dihydrochloride IUPAC Name: N-[3-(4-methylimidazol-1-yl)phenyl]-5,6-dihydrobenzo[h]quinazolin-4-amine dihydrochloride Traditional Name: 5,6-dihydrobenzo[h]quinazolin-4-yl-[3-(4-methylimidazol-1-yl)phenyl]amine dihydrochloride Formula: C22H21Cl2N5 MolecularWeight: 426.34164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C=N1)C2=CC(=CC=C2)NC3=NC=NC4=C3CCC5=CC=CC=C54.Cl.Cl

Isomeric SMILES

CC1=CN(C=N1)C2=CC(=CC=C2)NC3=NC=NC4=C3CCC5=CC=CC=C54.Cl.Cl

InChI

InChI=1S/C22H19N5.2ClH/c1-15-12-27(14-25-15)18-7-4-6-17(11-18)26-22-20-10-9-16-5-2-3-8-19(16)21(20)23-13-24-22;;/h2-8,11-14H,9-10H2,1H3,(H,23,24,26);2*1H