2-[7-(azepan-1-ylsulfonyl)-3-oxidanylidene-1,4-benzothiazin-4-yl]-N-prop-2-enyl-ethanamide

Systemtic Name: 2-[7-(azepan-1-ylsulfonyl)-3-oxidanylidene-1,4-benzothiazin-4-yl]-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[7-(azepan-1-ylsulfonyl)-3-oxo-1,4-benzothiazin-4-yl]acetamide CAS Name: 2-[7-(1-azepanylsulfonyl)-3-oxo-1,4-benzothiazin-4-yl]-N-prop-2-enylacetamide IUPAC Name: 2-[7-(azepan-1-ylsulfonyl)-3-oxo-1,4-benzothiazin-4-yl]-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[7-(azepan-1-ylsulfonyl)-3-keto-1,4-benzothiazin-4-yl]acetamide Formula: C19H25N3O4S2 MolecularWeight: 423.5495

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)CN1C(=O)CSC2=C1C=CC(=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

C=CCNC(=O)CN1C(=O)CSC2=C1C=CC(=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C19H25N3O4S2/c1-2-9-20-18(23)13-22-16-8-7-15(12-17(16)27-14-19(22)24)28(25,26)21-10-5-3-4-6-11-21/h2,7-8,12H,1,3-6,9-11,13-14H2,(H,20,23)