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

Systemtic Name: 3-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propyl-[(4-prop-2-enoxyphenyl)methyl]azanium Openeye Name: (4-allyloxyphenyl)methyl-[3-(1-phenyltetrazol-5-yl)sulfanylpropyl]ammonium CAS Name: 3-[(1-phenyl-5-tetrazolyl)thio]propyl-[(4-prop-2-enoxyphenyl)methyl]ammonium IUPAC Name: 3-(1-phenyltetrazol-5-yl)sulfanylpropyl-[(4-prop-2-enoxyphenyl)methyl]azanium Traditional Name: (4-allyloxybenzyl)-[3-[(1-phenyltetrazol-5-yl)thio]propyl]ammonium Formula: C20H24N5OS+ MolecularWeight: 382.50246

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=C(C=C1)C[NH2+]CCCSC2=NN=NN2C3=CC=CC=C3

Isomeric SMILES

C=CCOC1=CC=C(C=C1)C[NH2+]CCCSC2=NN=NN2C3=CC=CC=C3

InChI

InChI=1S/C20H23N5OS/c1-2-14-26-19-11-9-17(10-12-19)16-21-13-6-15-27-20-22-23-24-25(20)18-7-4-3-5-8-18/h2-5,7-12,21H,1,6,13-16H2/p+1