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

Systemtic Name: 2-[(2,5-dimethylphenyl)-(phenylsulfonyl)amino]-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-2,5-dimethyl-anilino]-N-(3-pyridylmethyl)acetamide CAS Name: 2-[N-(benzenesulfonyl)-2,5-dimethylanilino]-N-(3-pyridinylmethyl)acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-2,5-dimethylanilino]-N-(pyridin-3-ylmethyl)acetamide Traditional Name: 2-(N-besyl-2,5-dimethyl-anilino)-N-(3-pyridylmethyl)acetamide Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N(CC(=O)NCC2=CN=CC=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)N(CC(=O)NCC2=CN=CC=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H23N3O3S/c1-17-10-11-18(2)21(13-17)25(29(27,28)20-8-4-3-5-9-20)16-22(26)24-15-19-7-6-12-23-14-19/h3-14H,15-16H2,1-2H3,(H,24,26)