4-chloranyl-N-[(3,4-dimethoxyphenyl)methyl]-N-(pyridin-3-ylmethyl)benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[(3,4-dimethoxyphenyl)methyl]-N-(pyridin-3-ylmethyl)benzenesulfonamide Openeye Name: 4-chloro-N-[(3,4-dimethoxyphenyl)methyl]-N-(3-pyridylmethyl)benzenesulfonamide CAS Name: 4-chloro-N-[(3,4-dimethoxyphenyl)methyl]-N-(3-pyridinylmethyl)benzenesulfonamide IUPAC Name: 4-chloro-N-[(3,4-dimethoxyphenyl)methyl]-N-(pyridin-3-ylmethyl)benzenesulfonamide Traditional Name: 4-chloro-N-(3-pyridylmethyl)-N-veratryl-benzenesulfonamide Formula: C21H21ClN2O4S MolecularWeight: 432.92044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN(CC2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN(CC2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl)OC

InChI

InChI=1S/C21H21ClN2O4S/c1-27-20-10-5-16(12-21(20)28-2)14-24(15-17-4-3-11-23-13-17)29(25,26)19-8-6-18(22)7-9-19/h3-13H,14-15H2,1-2H3