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

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

Systemtic Name:methyl-[(4-phenyl-5-sulfanylidene-1,2,3,4-tetrazol-1-yl)methyl]-[(4-prop-2-enoxyphenyl)methyl]azanium
Openeye Name:(4-allyloxyphenyl)methyl-methyl-[(4-phenyl-5-thioxo-tetrazol-1-yl)methyl]ammonium
CAS Name:methyl-[(4-phenyl-5-sulfanylidene-1-tetrazolyl)methyl]-[(4-prop-2-enoxyphenyl)methyl]ammonium
IUPAC Name:methyl-[(4-phenyl-5-sulfanylidenetetrazol-1-yl)methyl]-[(4-prop-2-enoxyphenyl)methyl]azanium
Traditional Name:(4-allyloxybenzyl)-methyl-[(4-phenyl-5-thioxo-tetrazol-1-yl)methyl]ammonium
Formula: C19H22N5OS+
MolecularWeight: 368.47588
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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)OCC=C)CN2C(=S)N(N=N2)C3=CC=CC=C3


Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)OCC=C)CN2C(=S)N(N=N2)C3=CC=CC=C3


InChI

InChI=1S/C19H21N5OS/c1-3-13-25-18-11-9-16(10-12-18)14-22(2)15-23-19(26)24(21-20-23)17-7-5-4-6-8-17/h3-12H,1,13-15H2,2H3/p+1


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