(2-bromophenyl)methyl-methyl-[(4-propan-2-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium

Systemtic Name: (2-bromophenyl)methyl-methyl-[(4-propan-2-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Openeye Name: (2-bromophenyl)methyl-[(4-isopropyl-5-thioxo-1,2,4-triazol-1-yl)methyl]-methyl-ammonium CAS Name: (2-bromophenyl)methyl-methyl-[(4-propan-2-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]ammonium IUPAC Name: (2-bromophenyl)methyl-methyl-[(4-propan-2-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Traditional Name: (2-bromobenzyl)-[(4-isopropyl-5-thioxo-1,2,4-triazol-1-yl)methyl]-methyl-ammonium Formula: C14H20BrN4S+ MolecularWeight: 356.3044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NN(C1=S)C[NH+](C)CC2=CC=CC=C2Br

Isomeric SMILES

CC(C)N1C=NN(C1=S)C[NH+](C)CC2=CC=CC=C2Br

InChI

InChI=1S/C14H19BrN4S/c1-11(2)18-9-16-19(14(18)20)10-17(3)8-12-6-4-5-7-13(12)15/h4-7,9,11H,8,10H2,1-3H3/p+1