2-[6-(azepan-1-ylsulfonyl)-3-oxidanylidene-1,4-benzothiazin-4-yl]-N-cycloheptyl-ethanamide

Systemtic Name: 2-[6-(azepan-1-ylsulfonyl)-3-oxidanylidene-1,4-benzothiazin-4-yl]-N-cycloheptyl-ethanamide Openeye Name: 2-[6-(azepan-1-ylsulfonyl)-3-oxo-1,4-benzothiazin-4-yl]-N-cycloheptyl-acetamide CAS Name: 2-[6-(1-azepanylsulfonyl)-3-oxo-1,4-benzothiazin-4-yl]-N-cycloheptylacetamide IUPAC Name: 2-[6-(azepan-1-ylsulfonyl)-3-oxo-1,4-benzothiazin-4-yl]-N-cycloheptylacetamide Traditional Name: 2-[6-(azepan-1-ylsulfonyl)-3-keto-1,4-benzothiazin-4-yl]-N-cycloheptyl-acetamide Formula: C23H33N3O4S2 MolecularWeight: 479.65582

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)CN2C(=O)CSC3=C2C=C(C=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

C1CCCC(CC1)NC(=O)CN2C(=O)CSC3=C2C=C(C=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C23H33N3O4S2/c27-22(24-18-9-5-1-2-6-10-18)16-26-20-15-19(11-12-21(20)31-17-23(26)28)32(29,30)25-13-7-3-4-8-14-25/h11-12,15,18H,1-10,13-14,16-17H2,(H,24,27)