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

Systemtic Name: (5-bromanylthiophen-2-yl)methyl-ethyl-[(5-phenyl-3-sulfanylidene-1H-1,2,4-triazol-2-yl)methyl]azanium Openeye Name: (5-bromo-2-thienyl)methyl-ethyl-[(5-phenyl-3-thioxo-1H-1,2,4-triazol-2-yl)methyl]ammonium CAS Name: (5-bromo-2-thiophenyl)methyl-ethyl-[(5-phenyl-3-sulfanylidene-1H-1,2,4-triazol-2-yl)methyl]ammonium IUPAC Name: (5-bromothiophen-2-yl)methyl-ethyl-[(5-phenyl-3-sulfanylidene-1H-1,2,4-triazol-2-yl)methyl]azanium Traditional Name: (5-bromo-2-thienyl)methyl-ethyl-[(5-phenyl-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:

CC[NH+](CC1=CC=C(S1)Br)CN2C(=S)N=C(N2)C3=CC=CC=C3

Isomeric SMILES

CC[NH+](CC1=CC=C(S1)Br)CN2C(=S)N=C(N2)C3=CC=CC=C3

InChI

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