N-[(3-fluorophenyl)methyl]thian-4-amine

Systemtic Name: N-[(3-fluorophenyl)methyl]thian-4-amine Openeye Name: N-[(3-fluorophenyl)methyl]tetrahydrothiopyran-4-amine CAS Name: N-[(3-fluorophenyl)methyl]-4-thianamine IUPAC Name: N-[(3-fluorophenyl)methyl]thian-4-amine Traditional Name: (3-fluorobenzyl)-tetrahydrothiopyran-4-yl-amine Formula: C12H16FNS MolecularWeight: 225.325543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSCCC1NCC2=CC(=CC=C2)F

Isomeric SMILES

C1CSCCC1NCC2=CC(=CC=C2)F

InChI

InChI=1S/C12H16FNS/c13-11-3-1-2-10(8-11)9-14-12-4-6-15-7-5-12/h1-3,8,12,14H,4-7,9H2