N-[2-[(5-bromanylthiophen-2-yl)methylsulfanyl]ethyl]-2-(trifluoromethyl)quinazolin-4-amine

Systemtic Name: N-[2-[(5-bromanylthiophen-2-yl)methylsulfanyl]ethyl]-2-(trifluoromethyl)quinazolin-4-amine Openeye Name: N-[2-[(5-bromo-2-thienyl)methylsulfanyl]ethyl]-2-(trifluoromethyl)quinazolin-4-amine CAS Name: N-[2-[(5-bromo-2-thiophenyl)methylthio]ethyl]-2-(trifluoromethyl)-4-quinazolinamine IUPAC Name: N-[2-[(5-bromothiophen-2-yl)methylsulfanyl]ethyl]-2-(trifluoromethyl)quinazolin-4-amine Traditional Name: 2-[(5-bromo-2-thienyl)methylthio]ethyl-[2-(trifluoromethyl)quinazolin-4-yl]amine Formula: C16H13BrF3N3S2 MolecularWeight: 448.32373

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C(F)(F)F)NCCSCC3=CC=C(S3)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)C(F)(F)F)NCCSCC3=CC=C(S3)Br

InChI

InChI=1S/C16H13BrF3N3S2/c17-13-6-5-10(25-13)9-24-8-7-21-14-11-3-1-2-4-12(11)22-15(23-14)16(18,19)20/h1-6H,7-9H2,(H,21,22,23)