6-bromanyl-4-phenyl-N-[4-(trifluoromethylsulfonyl)phenyl]quinazolin-2-amine

Systemtic Name: 6-bromanyl-4-phenyl-N-[4-(trifluoromethylsulfonyl)phenyl]quinazolin-2-amine Openeye Name: 6-bromo-4-phenyl-N-[4-(trifluoromethylsulfonyl)phenyl]quinazolin-2-amine CAS Name: 6-bromo-4-phenyl-N-[4-(trifluoromethylsulfonyl)phenyl]-2-quinazolinamine IUPAC Name: 6-bromo-4-phenyl-N-[4-(trifluoromethylsulfonyl)phenyl]quinazolin-2-amine Traditional Name: (6-bromo-4-phenyl-quinazolin-2-yl)-(4-triflylphenyl)amine Formula: C21H13BrF3N3O2S MolecularWeight: 508.31103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Br)NC4=CC=C(C=C4)S(=O)(=O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Br)NC4=CC=C(C=C4)S(=O)(=O)C(F)(F)F

InChI

InChI=1S/C21H13BrF3N3O2S/c22-14-6-11-18-17(12-14)19(13-4-2-1-3-5-13)28-20(27-18)26-15-7-9-16(10-8-15)31(29,30)21(23,24)25/h1-12H,(H,26,27,28)