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

Systemtic Name: (5-bromanylthiophen-2-yl)methyl-[(4-cyclopropyl-3-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-methyl-azanium Openeye Name: (5-bromo-2-thienyl)methyl-[(4-cyclopropyl-3-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl]-methyl-ammonium CAS Name: (5-bromo-2-thiophenyl)methyl-[(4-cyclopropyl-3-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-methylammonium IUPAC Name: (5-bromothiophen-2-yl)methyl-[(4-cyclopropyl-3-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-methylazanium Traditional Name: (5-bromo-2-thienyl)methyl-[(4-cyclopropyl-3-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl]-methyl-ammonium Formula: C13H18BrN4S2+ MolecularWeight: 374.34282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=S)N1C2CC2)C[NH+](C)CC3=CC=C(S3)Br

Isomeric SMILES

CC1=NN(C(=S)N1C2CC2)C[NH+](C)CC3=CC=C(S3)Br

InChI

InChI=1S/C13H17BrN4S2/c1-9-15-17(13(19)18(9)10-3-4-10)8-16(2)7-11-5-6-12(14)20-11/h5-6,10H,3-4,7-8H2,1-2H3/p+1