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

Systemtic Name: 2-[7-(azepan-1-ylsulfonyl)-3-oxidanylidene-1,4-benzothiazin-4-yl]-N-(3-morpholin-4-ylpropyl)ethanamide Openeye Name: 2-[7-(azepan-1-ylsulfonyl)-3-oxo-1,4-benzothiazin-4-yl]-N-(3-morpholinopropyl)acetamide CAS Name: 2-[7-(1-azepanylsulfonyl)-3-oxo-1,4-benzothiazin-4-yl]-N-[3-(4-morpholinyl)propyl]acetamide IUPAC Name: 2-[7-(azepan-1-ylsulfonyl)-3-oxo-1,4-benzothiazin-4-yl]-N-(3-morpholin-4-ylpropyl)acetamide Traditional Name: 2-[7-(azepan-1-ylsulfonyl)-3-keto-1,4-benzothiazin-4-yl]-N-(3-morpholinopropyl)acetamide Formula: C23H34N4O5S2 MolecularWeight: 510.66986

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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)NCCCN4CCOCC4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)CS3)CC(=O)NCCCN4CCOCC4

InChI

InChI=1S/C23H34N4O5S2/c28-22(24-8-5-9-25-12-14-32-15-13-25)17-27-20-7-6-19(16-21(20)33-18-23(27)29)34(30,31)26-10-3-1-2-4-11-26/h6-7,16H,1-5,8-15,17-18H2,(H,24,28)