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

Systemtic Name: 2-[(4-methylphenyl)sulfonyl-phenethyl-amino]-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: 2-[phenethyl(p-tolylsulfonyl)amino]-N-(3-pyridylmethyl)acetamide CAS Name: 2-[(4-methylphenyl)sulfonyl-phenethylamino]-N-(3-pyridinylmethyl)acetamide IUPAC Name: 2-[(4-methylphenyl)sulfonyl-phenethylamino]-N-(pyridin-3-ylmethyl)acetamide Traditional Name: 2-[phenethyl(tosyl)amino]-N-(3-pyridylmethyl)acetamide Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCC2=CC=CC=C2)CC(=O)NCC3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCC2=CC=CC=C2)CC(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C23H25N3O3S/c1-19-9-11-22(12-10-19)30(28,29)26(15-13-20-6-3-2-4-7-20)18-23(27)25-17-21-8-5-14-24-16-21/h2-12,14,16H,13,15,17-18H2,1H3,(H,25,27)