(5-bromanylthiophen-2-yl)methyl-methyl-[[5-(4-methylphenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl]azanium

Systemtic Name: (5-bromanylthiophen-2-yl)methyl-methyl-[[5-(4-methylphenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl]azanium Openeye Name: (5-bromo-2-thienyl)methyl-methyl-[[5-(p-tolyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl]ammonium CAS Name: (5-bromo-2-thiophenyl)methyl-methyl-[[5-(4-methylphenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl]ammonium IUPAC Name: (5-bromothiophen-2-yl)methyl-methyl-[[5-(4-methylphenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl]azanium Traditional Name: (5-bromo-2-thienyl)methyl-methyl-[[5-(p-tolyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl]ammonium Formula: C16H18BrN4S2+ MolecularWeight: 410.37492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=S)N(N2)C[NH+](C)CC3=CC=C(S3)Br

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=S)N(N2)C[NH+](C)CC3=CC=C(S3)Br

InChI

InChI=1S/C16H17BrN4S2/c1-11-3-5-12(6-4-11)15-18-16(22)21(19-15)10-20(2)9-13-7-8-14(17)23-13/h3-8H,9-10H2,1-2H3,(H,18,19,22)/p+1