N-[2-(1,3-benzodioxol-5-yl)-5-cyano-6-methoxy-pyridin-3-yl]benzenesulfonamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)-5-cyano-6-methoxy-pyridin-3-yl]benzenesulfonamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)-5-cyano-6-methoxy-3-pyridyl]benzenesulfonamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)-5-cyano-6-methoxy-3-pyridinyl]benzenesulfonamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)-5-cyano-6-methoxypyridin-3-yl]benzenesulfonamide Traditional Name: N-[2-(1,3-benzodioxol-5-yl)-5-cyano-6-methoxy-3-pyridyl]benzenesulfonamide Formula: C20H15N3O5S MolecularWeight: 409.4152

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=C(C=C1C#N)NS(=O)(=O)C2=CC=CC=C2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=NC(=C(C=C1C#N)NS(=O)(=O)C2=CC=CC=C2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H15N3O5S/c1-26-20-14(11-21)9-16(23-29(24,25)15-5-3-2-4-6-15)19(22-20)13-7-8-17-18(10-13)28-12-27-17/h2-10,23H,12H2,1H3