6-iodanyl-N-[1-(phenylmethyl)indazol-5-yl]quinazolin-2-amine

Systemtic Name: 6-iodanyl-N-[1-(phenylmethyl)indazol-5-yl]quinazolin-2-amine Openeye Name: N-(1-benzylindazol-5-yl)-6-iodo-quinazolin-2-amine CAS Name: 6-iodo-N-[1-(phenylmethyl)-5-indazolyl]-2-quinazolinamine IUPAC Name: N-(1-benzylindazol-5-yl)-6-iodoquinazolin-2-amine Traditional Name: (1-benzylindazol-5-yl)-(6-iodoquinazolin-2-yl)amine Formula: C22H16IN5 MolecularWeight: 477.30041

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)NC4=NC=C5C=C(C=CC5=N4)I)C=N2

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)NC4=NC=C5C=C(C=CC5=N4)I)C=N2

InChI

InChI=1S/C22H16IN5/c23-18-6-8-20-16(10-18)12-24-22(27-20)26-19-7-9-21-17(11-19)13-25-28(21)14-15-4-2-1-3-5-15/h1-13H,14H2,(H,24,26,27)