(4-ethyl-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-methyl-(phenylmethyl)azanium

Systemtic Name: (4-ethyl-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[(4-ethyl-3-phenyl-5-thioxo-1,2,4-triazol-1-yl)methyl]-methyl-ammonium CAS Name: (4-ethyl-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[(4-ethyl-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-methylazanium Traditional Name: benzyl-[(4-ethyl-3-phenyl-5-thioxo-1,2,4-triazol-1-yl)methyl]-methyl-ammonium Formula: C19H23N4S+ MolecularWeight: 339.47772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)C[NH+](C)CC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCN1C(=NN(C1=S)C[NH+](C)CC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C19H22N4S/c1-3-22-18(17-12-8-5-9-13-17)20-23(19(22)24)15-21(2)14-16-10-6-4-7-11-16/h4-13H,3,14-15H2,1-2H3/p+1