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

Systemtic Name: (2,4-dimethylphenyl)methyl-[(4-ethyl-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-methyl-azanium Openeye Name: (2,4-dimethylphenyl)methyl-[(4-ethyl-3-phenyl-5-thioxo-1,2,4-triazol-1-yl)methyl]-methyl-ammonium CAS Name: (2,4-dimethylphenyl)methyl-[(4-ethyl-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-methylammonium IUPAC Name: (2,4-dimethylphenyl)methyl-[(4-ethyl-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-methylazanium Traditional Name: (2,4-dimethylbenzyl)-[(4-ethyl-3-phenyl-5-thioxo-1,2,4-triazol-1-yl)methyl]-methyl-ammonium Formula: C21H27N4S+ MolecularWeight: 367.53088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4S/c1-5-24-20(18-9-7-6-8-10-18)22-25(21(24)26)15-23(4)14-19-12-11-16(2)13-17(19)3/h6-13H,5,14-15H2,1-4H3/p+1