[4-(3,4-dimethylphenyl)-5-sulfanylidene-1,2,3,4-tetrazol-1-yl]methyl-methyl-(thiophen-3-ylmethyl)azanium

Systemtic Name: [4-(3,4-dimethylphenyl)-5-sulfanylidene-1,2,3,4-tetrazol-1-yl]methyl-methyl-(thiophen-3-ylmethyl)azanium Openeye Name: [4-(3,4-dimethylphenyl)-5-thioxo-tetrazol-1-yl]methyl-methyl-(3-thienylmethyl)ammonium CAS Name: [4-(3,4-dimethylphenyl)-5-sulfanylidene-1-tetrazolyl]methyl-methyl-(3-thiophenylmethyl)ammonium IUPAC Name: [4-(3,4-dimethylphenyl)-5-sulfanylidenetetrazol-1-yl]methyl-methyl-(thiophen-3-ylmethyl)azanium Traditional Name: [4-(3,4-dimethylphenyl)-5-thioxo-tetrazol-1-yl]methyl-methyl-(3-thenyl)ammonium Formula: C16H20N5S2+ MolecularWeight: 346.4935

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=S)N(N=N2)C[NH+](C)CC3=CSC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=S)N(N=N2)C[NH+](C)CC3=CSC=C3)C

InChI

InChI=1S/C16H19N5S2/c1-12-4-5-15(8-13(12)2)21-16(22)20(17-18-21)11-19(3)9-14-6-7-23-10-14/h4-8,10H,9,11H2,1-3H3/p+1