N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(2-oxidanylidenepyridin-1-yl)ethanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(2-oxidanylidenepyridin-1-yl)ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(2-oxo-1-pyridyl)acetamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-2-(2-oxo-1-pyridinyl)acetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-2-(2-oxopyridin-1-yl)acetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(2-keto-1-pyridyl)acetamide Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN2C=CC=CC2=O)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN2C=CC=CC2=O)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C20H25N3O4S/c1-16-9-10-17(21-19(24)15-22-11-7-4-8-20(22)25)14-18(16)28(26,27)23-12-5-2-3-6-13-23/h4,7-11,14H,2-3,5-6,12-13,15H2,1H3,(H,21,24)