2-[(3,4-dimethoxyphenyl)sulfonyl-phenethyl-amino]-N-(pyridin-3-ylmethyl)ethanamide

Systemtic Name: 2-[(3,4-dimethoxyphenyl)sulfonyl-phenethyl-amino]-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: 2-[(3,4-dimethoxyphenyl)sulfonyl-phenethyl-amino]-N-(3-pyridylmethyl)acetamide CAS Name: 2-[(3,4-dimethoxyphenyl)sulfonyl-phenethylamino]-N-(3-pyridinylmethyl)acetamide IUPAC Name: 2-[(3,4-dimethoxyphenyl)sulfonyl-phenethylamino]-N-(pyridin-3-ylmethyl)acetamide Traditional Name: 2-[(3,4-dimethoxyphenyl)sulfonyl-phenethyl-amino]-N-(3-pyridylmethyl)acetamide Formula: C24H27N3O5S MolecularWeight: 469.55328

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N(CCC2=CC=CC=C2)CC(=O)NCC3=CN=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N(CCC2=CC=CC=C2)CC(=O)NCC3=CN=CC=C3)OC

InChI

InChI=1S/C24H27N3O5S/c1-31-22-11-10-21(15-23(22)32-2)33(29,30)27(14-12-19-7-4-3-5-8-19)18-24(28)26-17-20-9-6-13-25-16-20/h3-11,13,15-16H,12,14,17-18H2,1-2H3,(H,26,28)