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

Systemtic Name: 3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propyl-[(3-phenylmethoxyphenyl)methyl]azanium Openeye Name: (3-benzyloxyphenyl)methyl-[3-(1-methyltetrazol-5-yl)sulfanylpropyl]ammonium CAS Name: 3-[(1-methyl-5-tetrazolyl)thio]propyl-[(3-phenylmethoxyphenyl)methyl]ammonium IUPAC Name: 3-(1-methyltetrazol-5-yl)sulfanylpropyl-[(3-phenylmethoxyphenyl)methyl]azanium Traditional Name: (3-benzoxybenzyl)-[3-[(1-methyltetrazol-5-yl)thio]propyl]ammonium Formula: C19H24N5OS+ MolecularWeight: 370.49176

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23N5OS/c1-24-19(21-22-23-24)26-12-6-11-20-14-17-9-5-10-18(13-17)25-15-16-7-3-2-4-8-16/h2-5,7-10,13,20H,6,11-12,14-15H2,1H3/p+1