2-[(2,5-dimethoxyphenyl)-(phenylsulfonyl)amino]-N-(pyridin-3-ylmethyl)ethanamide

Systemtic Name: 2-[(2,5-dimethoxyphenyl)-(phenylsulfonyl)amino]-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-2,5-dimethoxy-anilino]-N-(3-pyridylmethyl)acetamide CAS Name: 2-[N-(benzenesulfonyl)-2,5-dimethoxyanilino]-N-(3-pyridinylmethyl)acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-2,5-dimethoxyanilino]-N-(pyridin-3-ylmethyl)acetamide Traditional Name: 2-(N-besyl-2,5-dimethoxy-anilino)-N-(3-pyridylmethyl)acetamide Formula: C22H23N3O5S MolecularWeight: 441.50012

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)N(CC(=O)NCC2=CN=CC=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)N(CC(=O)NCC2=CN=CC=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H23N3O5S/c1-29-18-10-11-21(30-2)20(13-18)25(31(27,28)19-8-4-3-5-9-19)16-22(26)24-15-17-7-6-12-23-14-17/h3-14H,15-16H2,1-2H3,(H,24,26)