2-[5-cyano-2-(3,4-dimethylphenyl)-6-methoxy-pyridin-3-yl]benzenesulfonamide

Systemtic Name: 2-[5-cyano-2-(3,4-dimethylphenyl)-6-methoxy-pyridin-3-yl]benzenesulfonamide Openeye Name: 2-[5-cyano-2-(3,4-dimethylphenyl)-6-methoxy-3-pyridyl]benzenesulfonamide CAS Name: 2-[5-cyano-2-(3,4-dimethylphenyl)-6-methoxy-3-pyridinyl]benzenesulfonamide IUPAC Name: 2-[5-cyano-2-(3,4-dimethylphenyl)-6-methoxypyridin-3-yl]benzenesulfonamide Traditional Name: 2-[5-cyano-2-(3,4-dimethylphenyl)-6-methoxy-3-pyridyl]benzenesulfonamide Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(C=C(C(=N2)OC)C#N)C3=CC=CC=C3S(=O)(=O)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(C=C(C(=N2)OC)C#N)C3=CC=CC=C3S(=O)(=O)N)C

InChI

InChI=1S/C21H19N3O3S/c1-13-8-9-15(10-14(13)2)20-18(11-16(12-22)21(24-20)27-3)17-6-4-5-7-19(17)28(23,25)26/h4-11H,1-3H3,(H2,23,25,26)