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

Systemtic Name: methyl-[(1-phenylpyrazol-4-yl)methyl]-[(4-phenyl-5-sulfanylidene-1,2,3,4-tetrazol-1-yl)methyl]azanium Openeye Name: methyl-[(1-phenylpyrazol-4-yl)methyl]-[(4-phenyl-5-thioxo-tetrazol-1-yl)methyl]ammonium CAS Name: methyl-[(1-phenyl-4-pyrazolyl)methyl]-[(4-phenyl-5-sulfanylidene-1-tetrazolyl)methyl]ammonium IUPAC Name: methyl-[(1-phenylpyrazol-4-yl)methyl]-[(4-phenyl-5-sulfanylidenetetrazol-1-yl)methyl]azanium Traditional Name: methyl-[(1-phenylpyrazol-4-yl)methyl]-[(4-phenyl-5-thioxo-tetrazol-1-yl)methyl]ammonium Formula: C19H20N7S+ MolecularWeight: 378.474

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CN(N=C1)C2=CC=CC=C2)CN3C(=S)N(N=N3)C4=CC=CC=C4

Isomeric SMILES

C[NH+](CC1=CN(N=C1)C2=CC=CC=C2)CN3C(=S)N(N=N3)C4=CC=CC=C4

InChI

InChI=1S/C19H19N7S/c1-23(13-16-12-20-24(14-16)17-8-4-2-5-9-17)15-25-19(27)26(22-21-25)18-10-6-3-7-11-18/h2-12,14H,13,15H2,1H3/p+1