N-(2,6-dimethoxypyridin-3-yl)-2-[(4-methyl-5-quinolin-6-yl-1,2,4-triazol-3-yl)sulfanyl]-N-methylsulfonyl-ethanamide

Systemtic Name: N-(2,6-dimethoxypyridin-3-yl)-2-[(4-methyl-5-quinolin-6-yl-1,2,4-triazol-3-yl)sulfanyl]-N-methylsulfonyl-ethanamide Openeye Name: N-(2,6-dimethoxy-3-pyridyl)-2-[[4-methyl-5-(6-quinolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-methylsulfonyl-acetamide CAS Name: N-(2,6-dimethoxy-3-pyridinyl)-2-[[4-methyl-5-(6-quinolinyl)-1,2,4-triazol-3-yl]thio]-N-methylsulfonylacetamide IUPAC Name: N-(2,6-dimethoxypyridin-3-yl)-2-[(4-methyl-5-quinolin-6-yl-1,2,4-triazol-3-yl)sulfanyl]-N-methylsulfonylacetamide Traditional Name: N-(2,6-dimethoxy-3-pyridyl)-N-mesyl-2-[[4-methyl-5-(6-quinolyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C22H22N6O5S2 MolecularWeight: 514.57728

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)N(C2=C(N=C(C=C2)OC)OC)S(=O)(=O)C)C3=CC4=C(C=C3)N=CC=C4

Isomeric SMILES

CN1C(=NN=C1SCC(=O)N(C2=C(N=C(C=C2)OC)OC)S(=O)(=O)C)C3=CC4=C(C=C3)N=CC=C4

InChI

InChI=1S/C22H22N6O5S2/c1-27-20(15-7-8-16-14(12-15)6-5-11-23-16)25-26-22(27)34-13-19(29)28(35(4,30)31)17-9-10-18(32-2)24-21(17)33-3/h5-12H,13H2,1-4H3