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

Systemtic Name: 3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propyl-[(4-phenylmethoxyphenyl)methyl]azanium Openeye Name: (4-benzyloxyphenyl)methyl-[3-(1-methyltetrazol-5-yl)sulfanylpropyl]ammonium CAS Name: 3-[(1-methyl-5-tetrazolyl)thio]propyl-[(4-phenylmethoxyphenyl)methyl]ammonium IUPAC Name: 3-(1-methyltetrazol-5-yl)sulfanylpropyl-[(4-phenylmethoxyphenyl)methyl]azanium Traditional Name: (4-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=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

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

InChI

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