2-[6-bromanyl-2-propan-2-yloxy-4-(trifluoromethyl)quinolin-7-yl]sulfanylethanamine

Systemtic Name: 2-[6-bromanyl-2-propan-2-yloxy-4-(trifluoromethyl)quinolin-7-yl]sulfanylethanamine Openeye Name: 2-[[6-bromo-2-isopropoxy-4-(trifluoromethyl)-7-quinolyl]sulfanyl]ethanamine CAS Name: 2-[[6-bromo-2-propan-2-yloxy-4-(trifluoromethyl)-7-quinolinyl]thio]ethanamine IUPAC Name: 2-[6-bromo-2-propan-2-yloxy-4-(trifluoromethyl)quinolin-7-yl]sulfanylethanamine Traditional Name: 2-[[6-bromo-2-isopropoxy-4-(trifluoromethyl)-7-quinolyl]thio]ethylamine Formula: C15H16BrF3N2OS MolecularWeight: 409.26455

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=NC2=CC(=C(C=C2C(=C1)C(F)(F)F)Br)SCCN

Isomeric SMILES

CC(C)OC1=NC2=CC(=C(C=C2C(=C1)C(F)(F)F)Br)SCCN

InChI

InChI=1S/C15H16BrF3N2OS/c1-8(2)22-14-6-10(15(17,18)19)9-5-11(16)13(23-4-3-20)7-12(9)21-14/h5-8H,3-4,20H2,1-2H3