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

Systemtic Name: dibutyl-[(4-phenyl-5-sulfanylidene-1,2,3,4-tetrazol-1-yl)methyl]azanium Openeye Name: dibutyl-[(4-phenyl-5-thioxo-tetrazol-1-yl)methyl]ammonium CAS Name: dibutyl-[(4-phenyl-5-sulfanylidene-1-tetrazolyl)methyl]ammonium IUPAC Name: dibutyl-[(4-phenyl-5-sulfanylidenetetrazol-1-yl)methyl]azanium Traditional Name: dibutyl-[(4-phenyl-5-thioxo-tetrazol-1-yl)methyl]ammonium Formula: C16H26N5S+ MolecularWeight: 320.47614

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)CN1C(=S)N(N=N1)C2=CC=CC=C2

Isomeric SMILES

CCCC[NH+](CCCC)CN1C(=S)N(N=N1)C2=CC=CC=C2

InChI

InChI=1S/C16H25N5S/c1-3-5-12-19(13-6-4-2)14-20-16(22)21(18-17-20)15-10-8-7-9-11-15/h7-11H,3-6,12-14H2,1-2H3/p+1