N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methoxy-N-[(1-methylpyrazol-4-yl)methyl]benzenesulfonamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methoxy-N-[(1-methylpyrazol-4-yl)methyl]benzenesulfonamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methoxy-N-[(1-methylpyrazol-4-yl)methyl]benzenesulfonamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methoxy-N-[(1-methyl-4-pyrazolyl)methyl]benzenesulfonamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methoxy-N-[(1-methylpyrazol-4-yl)methyl]benzenesulfonamide Traditional Name: N-homoveratryl-4-methoxy-N-[(1-methylpyrazol-4-yl)methyl]benzenesulfonamide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CN(CCC2=CC(=C(C=C2)OC)OC)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CN1C=C(C=N1)CN(CCC2=CC(=C(C=C2)OC)OC)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H27N3O5S/c1-24-15-18(14-23-24)16-25(31(26,27)20-8-6-19(28-2)7-9-20)12-11-17-5-10-21(29-3)22(13-17)30-4/h5-10,13-15H,11-12,16H2,1-4H3