5-heptan-2-yl-4,6-dimethyl-quinazoline-2-carboxamide dihydrochloride

Systemtic Name: 5-heptan-2-yl-4,6-dimethyl-quinazoline-2-carboxamide dihydrochloride Openeye Name: 4,6-dimethyl-5-(1-methylhexyl)quinazoline-2-carboxamide dihydrochloride CAS Name: 5-heptan-2-yl-4,6-dimethyl-2-quinazolinecarboxamide dihydrochloride IUPAC Name: 5-heptan-2-yl-4,6-dimethylquinazoline-2-carboxamide dihydrochloride Traditional Name: 4,6-dimethyl-5-(1-methylhexyl)quinazoline-2-carboxamide dihydrochloride Formula: C18H27Cl2N3O MolecularWeight: 372.33248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)C1=C(C=CC2=C1C(=NC(=N2)C(=O)N)C)C.Cl.Cl

Isomeric SMILES

CCCCCC(C)C1=C(C=CC2=C1C(=NC(=N2)C(=O)N)C)C.Cl.Cl

InChI

InChI=1S/C18H25N3O.2ClH/c1-5-6-7-8-11(2)15-12(3)9-10-14-16(15)13(4)20-18(21-14)17(19)22;;/h9-11H,5-8H2,1-4H3,(H2,19,22);2*1H