N-[2-(hydroxymethyl)-3,6-dimethyl-phenyl]-4-methoxy-N-(pyridin-3-ylmethyl)benzenesulfonamide

Systemtic Name: N-[2-(hydroxymethyl)-3,6-dimethyl-phenyl]-4-methoxy-N-(pyridin-3-ylmethyl)benzenesulfonamide Openeye Name: N-[2-(hydroxymethyl)-3,6-dimethyl-phenyl]-4-methoxy-N-(3-pyridylmethyl)benzenesulfonamide CAS Name: N-[2-(hydroxymethyl)-3,6-dimethylphenyl]-4-methoxy-N-(3-pyridinylmethyl)benzenesulfonamide IUPAC Name: N-[2-(hydroxymethyl)-3,6-dimethylphenyl]-4-methoxy-N-(pyridin-3-ylmethyl)benzenesulfonamide Traditional Name: N-(3,6-dimethyl-2-methylol-phenyl)-4-methoxy-N-(3-pyridylmethyl)benzenesulfonamide Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)N(CC2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)OC)CO

Isomeric SMILES

CC1=C(C(=C(C=C1)C)N(CC2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)OC)CO

InChI

InChI=1S/C22H24N2O4S/c1-16-6-7-17(2)22(21(16)15-25)24(14-18-5-4-12-23-13-18)29(26,27)20-10-8-19(28-3)9-11-20/h4-13,25H,14-15H2,1-3H3