[4-(4-methoxyphenyl)-5-sulfanylidene-1,2,3,4-tetrazol-1-yl]methyl-methyl-(phenylmethyl)azanium

Systemtic Name: [4-(4-methoxyphenyl)-5-sulfanylidene-1,2,3,4-tetrazol-1-yl]methyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[[4-(4-methoxyphenyl)-5-thioxo-tetrazol-1-yl]methyl]-methyl-ammonium CAS Name: [4-(4-methoxyphenyl)-5-sulfanylidene-1-tetrazolyl]methyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[[4-(4-methoxyphenyl)-5-sulfanylidenetetrazol-1-yl]methyl]-methylazanium Traditional Name: benzyl-[[4-(4-methoxyphenyl)-5-thioxo-tetrazol-1-yl]methyl]-methyl-ammonium Formula: C17H20N5OS+ MolecularWeight: 342.4386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N5OS/c1-20(12-14-6-4-3-5-7-14)13-21-17(24)22(19-18-21)15-8-10-16(23-2)11-9-15/h3-11H,12-13H2,1-2H3/p+1