6-chloranyl-2-imidazol-1-yl-N-(oxan-4-ylmethyl)quinazolin-4-amine dihydrochloride

Systemtic Name: 6-chloranyl-2-imidazol-1-yl-N-(oxan-4-ylmethyl)quinazolin-4-amine dihydrochloride Openeye Name: 6-chloro-2-imidazol-1-yl-N-(tetrahydropyran-4-ylmethyl)quinazolin-4-amine dihydrochloride CAS Name: 6-chloro-2-(1-imidazolyl)-N-(4-oxanylmethyl)-4-quinazolinamine dihydrochloride IUPAC Name: 6-chloro-2-imidazol-1-yl-N-(oxan-4-ylmethyl)quinazolin-4-amine dihydrochloride Traditional Name: (6-chloro-2-imidazol-1-yl-quinazolin-4-yl)-(tetrahydropyran-4-ylmethyl)amine dihydrochloride Formula: C17H20Cl3N5O MolecularWeight: 416.7326

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1CNC2=NC(=NC3=C2C=C(C=C3)Cl)N4C=CN=C4.Cl.Cl

Isomeric SMILES

C1COCCC1CNC2=NC(=NC3=C2C=C(C=C3)Cl)N4C=CN=C4.Cl.Cl

InChI

InChI=1S/C17H18ClN5O.2ClH/c18-13-1-2-15-14(9-13)16(20-10-12-3-7-24-8-4-12)22-17(21-15)23-6-5-19-11-23;;/h1-2,5-6,9,11-12H,3-4,7-8,10H2,(H,20,21,22);2*1H