6-(2-cyanopyridin-4-yl)-2-(2-hydroxyethyloxy)-3,6-dimethoxy-3-(2-methoxyphenoxy)-5-pyrimidin-4-yl-cyclohexa-1,4-diene-1-sulfonamide

Systemtic Name: 6-(2-cyanopyridin-4-yl)-2-(2-hydroxyethyloxy)-3,6-dimethoxy-3-(2-methoxyphenoxy)-5-pyrimidin-4-yl-cyclohexa-1,4-diene-1-sulfonamide Openeye Name: 6-(2-cyano-4-pyridyl)-2-(2-hydroxyethoxy)-3,6-dimethoxy-3-(2-methoxyphenoxy)-5-pyrimidin-4-yl-cyclohexa-1,4-diene-1-sulfonamide CAS Name: 6-(2-cyano-4-pyridinyl)-2-(2-hydroxyethoxy)-3,6-dimethoxy-3-(2-methoxyphenoxy)-5-(4-pyrimidinyl)-1-cyclohexa-1,4-dienesulfonamide IUPAC Name: 6-(2-cyanopyridin-4-yl)-2-(2-hydroxyethoxy)-3,6-dimethoxy-3-(2-methoxyphenoxy)-5-pyrimidin-4-ylcyclohexa-1,4-diene-1-sulfonamide Traditional Name: 6-(2-cyano-4-pyridyl)-2-(2-hydroxyethoxy)-3,6-dimethoxy-3-(2-methoxyphenoxy)-5-(4-pyrimidyl)cyclohexa-1,4-diene-1-sulfonamide Formula: C27H27N5O8S MolecularWeight: 581.59698

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OC2(C=C(C(C(=C2OCCO)S(=O)(=O)N)(C3=CC(=NC=C3)C#N)OC)C4=NC=NC=C4)OC

Isomeric SMILES

COC1=CC=CC=C1OC2(C=C(C(C(=C2OCCO)S(=O)(=O)N)(C3=CC(=NC=C3)C#N)OC)C4=NC=NC=C4)OC

InChI

InChI=1S/C27H27N5O8S/c1-36-22-6-4-5-7-23(22)40-26(37-2)15-20(21-9-10-30-17-32-21)27(38-3,18-8-11-31-19(14-18)16-28)25(41(29,34)35)24(26)39-13-12-33/h4-11,14-15,17,33H,12-13H2,1-3H3,(H2,29,34,35)