2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethyl-[(3-prop-2-enoxyphenyl)methyl]azanium

Systemtic Name: 2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethyl-[(3-prop-2-enoxyphenyl)methyl]azanium Openeye Name: (3-allyloxyphenyl)methyl-[2-(1-methyltetrazol-5-yl)sulfanylethyl]ammonium CAS Name: 2-[(1-methyl-5-tetrazolyl)thio]ethyl-[(3-prop-2-enoxyphenyl)methyl]ammonium IUPAC Name: 2-(1-methyltetrazol-5-yl)sulfanylethyl-[(3-prop-2-enoxyphenyl)methyl]azanium Traditional Name: (3-allyloxybenzyl)-[2-[(1-methyltetrazol-5-yl)thio]ethyl]ammonium Formula: C14H20N5OS+ MolecularWeight: 306.4065

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCC[NH2+]CC2=CC(=CC=C2)OCC=C

Isomeric SMILES

CN1C(=NN=N1)SCC[NH2+]CC2=CC(=CC=C2)OCC=C

InChI

InChI=1S/C14H19N5OS/c1-3-8-20-13-6-4-5-12(10-13)11-15-7-9-21-14-16-17-18-19(14)2/h3-6,10,15H,1,7-9,11H2,2H3/p+1