N,N-dimethyl-3-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]benzenesulfonamide

Systemtic Name: N,N-dimethyl-3-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]benzenesulfonamide Openeye Name: N,N-dimethyl-3-[[4-methyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]benzenesulfonamide CAS Name: N,N-dimethyl-3-[[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]methyl]benzenesulfonamide IUPAC Name: N,N-dimethyl-3-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]benzenesulfonamide Traditional Name: N,N-dimethyl-3-[[[4-methyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]benzenesulfonamide Formula: C17H19N5O2S2 MolecularWeight: 389.49506

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC(=CC=C2)S(=O)(=O)N(C)C)C3=CC=NC=C3

Isomeric SMILES

CN1C(=NN=C1SCC2=CC(=CC=C2)S(=O)(=O)N(C)C)C3=CC=NC=C3

InChI

InChI=1S/C17H19N5O2S2/c1-21(2)26(23,24)15-6-4-5-13(11-15)12-25-17-20-19-16(22(17)3)14-7-9-18-10-8-14/h4-11H,12H2,1-3H3