6-chloranyl-7-fluoranyl-N-(3-iodanyl-4-phenylmethoxy-phenyl)quinazolin-4-amine

Systemtic Name: 6-chloranyl-7-fluoranyl-N-(3-iodanyl-4-phenylmethoxy-phenyl)quinazolin-4-amine Openeye Name: N-(4-benzyloxy-3-iodo-phenyl)-6-chloro-7-fluoro-quinazolin-4-amine CAS Name: 6-chloro-7-fluoro-N-(3-iodo-4-phenylmethoxyphenyl)-4-quinazolinamine IUPAC Name: 6-chloro-7-fluoro-N-(3-iodo-4-phenylmethoxyphenyl)quinazolin-4-amine Traditional Name: (4-benzoxy-3-iodo-phenyl)-(6-chloro-7-fluoro-quinazolin-4-yl)amine Formula: C21H14ClFIN3O MolecularWeight: 505.711233

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)NC3=NC=NC4=CC(=C(C=C43)Cl)F)I

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)NC3=NC=NC4=CC(=C(C=C43)Cl)F)I

InChI

InChI=1S/C21H14ClFIN3O/c22-16-9-15-19(10-17(16)23)25-12-26-21(15)27-14-6-7-20(18(24)8-14)28-11-13-4-2-1-3-5-13/h1-10,12H,11H2,(H,25,26,27)