[3-fluoranyl-4-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]phenyl]methanamine

Systemtic Name: [3-fluoranyl-4-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]phenyl]methanamine Openeye Name: [3-fluoro-4-[(1-methyltetrazol-5-yl)sulfanylmethyl]phenyl]methanamine CAS Name: [3-fluoro-4-[[(1-methyl-5-tetrazolyl)thio]methyl]phenyl]methanamine IUPAC Name: [3-fluoro-4-[(1-methyltetrazol-5-yl)sulfanylmethyl]phenyl]methanamine Traditional Name: [3-fluoro-4-[[(1-methyltetrazol-5-yl)thio]methyl]benzyl]amine Formula: C10H12FN5S MolecularWeight: 253.299183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCC2=C(C=C(C=C2)CN)F

Isomeric SMILES

CN1C(=NN=N1)SCC2=C(C=C(C=C2)CN)F

InChI

InChI=1S/C10H12FN5S/c1-16-10(13-14-15-16)17-6-8-3-2-7(5-12)4-9(8)11/h2-4H,5-6,12H2,1H3