[3-[(4-fluorophenyl)methoxy]phenyl]methyl-[3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propyl]azanium

Systemtic Name: [3-[(4-fluorophenyl)methoxy]phenyl]methyl-[3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propyl]azanium Openeye Name: [3-[(4-fluorophenyl)methoxy]phenyl]methyl-[3-(1-methyltetrazol-5-yl)sulfanylpropyl]ammonium CAS Name: [3-[(4-fluorophenyl)methoxy]phenyl]methyl-[3-[(1-methyl-5-tetrazolyl)thio]propyl]ammonium IUPAC Name: [3-[(4-fluorophenyl)methoxy]phenyl]methyl-[3-(1-methyltetrazol-5-yl)sulfanylpropyl]azanium Traditional Name: [3-(4-fluorobenzyl)oxybenzyl]-[3-[(1-methyltetrazol-5-yl)thio]propyl]ammonium Formula: C19H23FN5OS+ MolecularWeight: 388.482223

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCCC[NH2+]CC2=CC(=CC=C2)OCC3=CC=C(C=C3)F

Isomeric SMILES

CN1C(=NN=N1)SCCC[NH2+]CC2=CC(=CC=C2)OCC3=CC=C(C=C3)F

InChI

InChI=1S/C19H22FN5OS/c1-25-19(22-23-24-25)27-11-3-10-21-13-16-4-2-5-18(12-16)26-14-15-6-8-17(20)9-7-15/h2,4-9,12,21H,3,10-11,13-14H2,1H3/p+1