6-iodanyl-N-(phenylmethyl)-2-pyridin-3-yl-quinazolin-4-amine dihydrochloride

Systemtic Name: 6-iodanyl-N-(phenylmethyl)-2-pyridin-3-yl-quinazolin-4-amine dihydrochloride Openeye Name: N-benzyl-6-iodo-2-(3-pyridyl)quinazolin-4-amine dihydrochloride CAS Name: 6-iodo-N-(phenylmethyl)-2-(3-pyridinyl)-4-quinazolinamine dihydrochloride IUPAC Name: N-benzyl-6-iodo-2-pyridin-3-ylquinazolin-4-amine dihydrochloride Traditional Name: benzyl-[6-iodo-2-(3-pyridyl)quinazolin-4-yl]amine dihydrochloride Formula: C20H17Cl2IN4 MolecularWeight: 511.18625

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC(=NC3=C2C=C(C=C3)I)C4=CN=CC=C4.Cl.Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC(=NC3=C2C=C(C=C3)I)C4=CN=CC=C4.Cl.Cl

InChI

InChI=1S/C20H15IN4.2ClH/c21-16-8-9-18-17(11-16)20(23-12-14-5-2-1-3-6-14)25-19(24-18)15-7-4-10-22-13-15;;/h1-11,13H,12H2,(H,23,24,25);2*1H