N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-[2-(2-oxidanylidenepyrrolidin-1-yl)-1,3-thiazol-4-yl]ethanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-[2-(2-oxidanylidenepyrrolidin-1-yl)-1,3-thiazol-4-yl]ethanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-[2-(2-oxopyrrolidin-1-yl)thiazol-4-yl]acetamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-2-[2-(2-oxo-1-pyrrolidinyl)-4-thiazolyl]acetamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]acetamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-[2-(2-ketopyrrolidino)thiazol-4-yl]acetamide Formula: C22H28N4O5S2 MolecularWeight: 492.61152

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)CC3=CSC(=N3)N4CCCC4=O

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)CC3=CSC(=N3)N4CCCC4=O

InChI

InChI=1S/C22H28N4O5S2/c1-31-19-9-8-17(33(29,30)25-10-4-2-3-5-11-25)14-18(19)24-20(27)13-16-15-32-22(23-16)26-12-6-7-21(26)28/h8-9,14-15H,2-7,10-13H2,1H3,(H,24,27)