N-[4-bromanyl-3-(trifluoromethyl)phenyl]thian-4-amine

Systemtic Name: N-[4-bromanyl-3-(trifluoromethyl)phenyl]thian-4-amine Openeye Name: N-[4-bromo-3-(trifluoromethyl)phenyl]tetrahydrothiopyran-4-amine CAS Name: N-[4-bromo-3-(trifluoromethyl)phenyl]-4-thianamine IUPAC Name: N-[4-bromo-3-(trifluoromethyl)phenyl]thian-4-amine Traditional Name: [4-bromo-3-(trifluoromethyl)phenyl]-tetrahydrothiopyran-4-yl-amine Formula: C12H13BrF3NS MolecularWeight: 340.20253

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCC1NC2=CC(=C(C=C2)Br)C(F)(F)F

Isomeric SMILES

C1CSCCC1NC2=CC(=C(C=C2)Br)C(F)(F)F

InChI

InChI=1S/C12H13BrF3NS/c13-11-2-1-9(7-10(11)12(14,15)16)17-8-3-5-18-6-4-8/h1-2,7-8,17H,3-6H2