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

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-[2-(2-oxidanylidenepyrrolidin-1-yl)-1,3-thiazol-4-yl]ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-[2-(2-oxopyrrolidin-1-yl)thiazol-4-yl]acetamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-2-[2-(2-oxo-1-pyrrolidinyl)-4-thiazolyl]acetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]acetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-[2-(2-ketopyrrolidino)thiazol-4-yl]acetamide Formula: C22H28N4O4S2 MolecularWeight: 476.61212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CC2=CSC(=N2)N3CCCC3=O)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CC2=CSC(=N2)N3CCCC3=O)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C22H28N4O4S2/c1-16-8-9-17(13-19(16)32(29,30)25-10-4-2-3-5-11-25)23-20(27)14-18-15-31-22(24-18)26-12-6-7-21(26)28/h8-9,13,15H,2-7,10-12,14H2,1H3,(H,23,27)