N-[2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylphenyl]-4-methoxy-benzenesulfonamide

Systemtic Name: N-[2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylphenyl]-4-methoxy-benzenesulfonamide Openeye Name: N-[2-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]phenyl]-4-methoxy-benzenesulfonamide CAS Name: N-[2-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]phenyl]-4-methoxybenzenesulfonamide IUPAC Name: N-[2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanylphenyl]-4-methoxybenzenesulfonamide Traditional Name: N-[2-[(3-cyano-4,6-dimethyl-2-pyridyl)thio]phenyl]-4-methoxy-benzenesulfonamide Formula: C21H19N3O3S2 MolecularWeight: 425.52386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SC2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SC2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C21H19N3O3S2/c1-14-12-15(2)23-21(18(14)13-22)28-20-7-5-4-6-19(20)24-29(25,26)17-10-8-16(27-3)9-11-17/h4-12,24H,1-3H3