(5-bromanyl-2-methoxy-phenyl)methyl-[(4-ethyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-methyl-azanium

Systemtic Name: (5-bromanyl-2-methoxy-phenyl)methyl-[(4-ethyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-methyl-azanium Openeye Name: (5-bromo-2-methoxy-phenyl)methyl-[(4-ethyl-5-thioxo-1,2,4-triazol-1-yl)methyl]-methyl-ammonium CAS Name: (5-bromo-2-methoxyphenyl)methyl-[(4-ethyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-methylammonium IUPAC Name: (5-bromo-2-methoxyphenyl)methyl-[(4-ethyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-methylazanium Traditional Name: (5-bromo-2-methoxy-benzyl)-[(4-ethyl-5-thioxo-1,2,4-triazol-1-yl)methyl]-methyl-ammonium Formula: C14H20BrN4OS+ MolecularWeight: 372.3038

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NN(C1=S)C[NH+](C)CC2=C(C=CC(=C2)Br)OC

Isomeric SMILES

CCN1C=NN(C1=S)C[NH+](C)CC2=C(C=CC(=C2)Br)OC

InChI

InChI=1S/C14H19BrN4OS/c1-4-18-9-16-19(14(18)21)10-17(2)8-11-7-12(15)5-6-13(11)20-3/h5-7,9H,4,8,10H2,1-3H3/p+1