(5-bromanylthiophen-2-yl)methyl-methyl-[(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)methyl]azanium

Systemtic Name: (5-bromanylthiophen-2-yl)methyl-methyl-[(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)methyl]azanium Openeye Name: (5-bromo-2-thienyl)methyl-methyl-[[5-oxo-4-(2-thienyl)tetrazol-1-yl]methyl]ammonium CAS Name: (5-bromo-2-thiophenyl)methyl-methyl-[(5-oxo-4-thiophen-2-yl-1-tetrazolyl)methyl]ammonium IUPAC Name: (5-bromothiophen-2-yl)methyl-methyl-[(5-oxo-4-thiophen-2-yltetrazol-1-yl)methyl]azanium Traditional Name: (5-bromo-2-thienyl)methyl-[[5-keto-4-(2-thienyl)tetrazol-1-yl]methyl]-methyl-ammonium Formula: C12H13BrN5OS2+ MolecularWeight: 387.29852

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(S1)Br)CN2C(=O)N(N=N2)C3=CC=CS3

Isomeric SMILES

C[NH+](CC1=CC=C(S1)Br)CN2C(=O)N(N=N2)C3=CC=CS3

InChI

InChI=1S/C12H12BrN5OS2/c1-16(7-9-4-5-10(13)21-9)8-17-12(19)18(15-14-17)11-3-2-6-20-11/h2-6H,7-8H2,1H3/p+1