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

Systemtic Name: (3,4-dimethoxyphenyl)methyl-methyl-[(5-phenyl-3-sulfanylidene-1H-1,2,4-triazol-2-yl)methyl]azanium Openeye Name: (3,4-dimethoxyphenyl)methyl-methyl-[(5-phenyl-3-thioxo-1H-1,2,4-triazol-2-yl)methyl]ammonium CAS Name: (3,4-dimethoxyphenyl)methyl-methyl-[(5-phenyl-3-sulfanylidene-1H-1,2,4-triazol-2-yl)methyl]ammonium IUPAC Name: (3,4-dimethoxyphenyl)methyl-methyl-[(5-phenyl-3-sulfanylidene-1H-1,2,4-triazol-2-yl)methyl]azanium Traditional Name: methyl-[(5-phenyl-3-thioxo-1H-1,2,4-triazol-2-yl)methyl]-veratryl-ammonium Formula: C19H23N4O2S+ MolecularWeight: 371.47652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N4O2S/c1-22(12-14-9-10-16(24-2)17(11-14)25-3)13-23-19(26)20-18(21-23)15-7-5-4-6-8-15/h4-11H,12-13H2,1-3H3,(H,20,21,26)/p+1