2-(3-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-1,4-benzothiazin-4-yl)-N-phenethyl-ethanamide

Systemtic Name: 2-(3-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-1,4-benzothiazin-4-yl)-N-phenethyl-ethanamide Openeye Name: 2-(3-oxo-6-pyrrolidin-1-ylsulfonyl-1,4-benzothiazin-4-yl)-N-phenethyl-acetamide CAS Name: 2-[3-oxo-6-(1-pyrrolidinylsulfonyl)-1,4-benzothiazin-4-yl]-N-phenethylacetamide IUPAC Name: 2-(3-oxo-6-pyrrolidin-1-ylsulfonyl-1,4-benzothiazin-4-yl)-N-phenethylacetamide Traditional Name: 2-(3-keto-6-pyrrolidinosulfonyl-1,4-benzothiazin-4-yl)-N-phenethyl-acetamide Formula: C22H25N3O4S2 MolecularWeight: 459.5816

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)SCC(=O)N3CC(=O)NCCC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)SCC(=O)N3CC(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C22H25N3O4S2/c26-21(23-11-10-17-6-2-1-3-7-17)15-25-19-14-18(8-9-20(19)30-16-22(25)27)31(28,29)24-12-4-5-13-24/h1-3,6-9,14H,4-5,10-13,15-16H2,(H,23,26)