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

Systemtic Name: 2-[7-(azepan-1-ylsulfonyl)-3-oxidanylidene-1,4-benzothiazin-4-yl]-N-[2-(cyclohexen-1-yl)ethyl]ethanamide Openeye Name: 2-[7-(azepan-1-ylsulfonyl)-3-oxo-1,4-benzothiazin-4-yl]-N-[2-(cyclohexen-1-yl)ethyl]acetamide CAS Name: 2-[7-(1-azepanylsulfonyl)-3-oxo-1,4-benzothiazin-4-yl]-N-[2-(1-cyclohexenyl)ethyl]acetamide IUPAC Name: 2-[7-(azepan-1-ylsulfonyl)-3-oxo-1,4-benzothiazin-4-yl]-N-[2-(cyclohexen-1-yl)ethyl]acetamide Traditional Name: 2-[7-(azepan-1-ylsulfonyl)-3-keto-1,4-benzothiazin-4-yl]-N-[2-(cyclohexen-1-yl)ethyl]acetamide Formula: C24H33N3O4S2 MolecularWeight: 491.66652

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)CS3)CC(=O)NCCC4=CCCCC4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)CS3)CC(=O)NCCC4=CCCCC4

InChI

InChI=1S/C24H33N3O4S2/c28-23(25-13-12-19-8-4-3-5-9-19)17-27-21-11-10-20(16-22(21)32-18-24(27)29)33(30,31)26-14-6-1-2-7-15-26/h8,10-11,16H,1-7,9,12-15,17-18H2,(H,25,28)