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

Systemtic Name: (2,4-dimethylphenyl)methyl-methyl-[(4-methyl-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Openeye Name: (2,4-dimethylphenyl)methyl-methyl-[(4-methyl-3-phenyl-5-thioxo-1,2,4-triazol-1-yl)methyl]ammonium CAS Name: (2,4-dimethylphenyl)methyl-methyl-[(4-methyl-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]ammonium IUPAC Name: (2,4-dimethylphenyl)methyl-methyl-[(4-methyl-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Traditional Name: (2,4-dimethylbenzyl)-methyl-[(4-methyl-3-phenyl-5-thioxo-1,2,4-triazol-1-yl)methyl]ammonium Formula: C20H25N4S+ MolecularWeight: 353.5043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C[NH+](C)CN2C(=S)N(C(=N2)C3=CC=CC=C3)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C[NH+](C)CN2C(=S)N(C(=N2)C3=CC=CC=C3)C)C

InChI

InChI=1S/C20H24N4S/c1-15-10-11-18(16(2)12-15)13-22(3)14-24-20(25)23(4)19(21-24)17-8-6-5-7-9-17/h5-12H,13-14H2,1-4H3/p+1