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

Systemtic Name: (4,5-dimethoxy-2-methyl-phenyl)methyl-methyl-[(4-methyl-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Openeye Name: (4,5-dimethoxy-2-methyl-phenyl)methyl-methyl-[[4-methyl-3-(4-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]ammonium CAS Name: (4,5-dimethoxy-2-methylphenyl)methyl-methyl-[(4-methyl-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]ammonium IUPAC Name: (4,5-dimethoxy-2-methylphenyl)methyl-methyl-[(4-methyl-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Traditional Name: (4,5-dimethoxy-2-methyl-benzyl)-methyl-[[4-methyl-3-(4-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]ammonium Formula: C20H26N5O2S+ MolecularWeight: 400.51774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C[NH+](C)CN2C(=S)N(C(=N2)C3=CC=NC=C3)C)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1C[NH+](C)CN2C(=S)N(C(=N2)C3=CC=NC=C3)C)OC)OC

InChI

InChI=1S/C20H25N5O2S/c1-14-10-17(26-4)18(27-5)11-16(14)12-23(2)13-25-20(28)24(3)19(22-25)15-6-8-21-9-7-15/h6-11H,12-13H2,1-5H3/p+1