2-(azepan-1-yl)-N-(6-morpholin-4-ylsulfonyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-(azepan-1-yl)-N-(6-morpholin-4-ylsulfonyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-(azepan-1-yl)-N-(6-morpholinosulfonyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-(1-azepanyl)-N-[6-(4-morpholinylsulfonyl)-1,3-benzothiazol-2-yl]acetamide IUPAC Name: 2-(azepan-1-yl)-N-(6-morpholin-4-ylsulfonyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-(azepan-1-yl)-N-(6-morpholinosulfonyl-1,3-benzothiazol-2-yl)acetamide Formula: C19H26N4O4S2 MolecularWeight: 438.56414

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CCCN(CC1)CC(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C19H26N4O4S2/c24-18(14-22-7-3-1-2-4-8-22)21-19-20-16-6-5-15(13-17(16)28-19)29(25,26)23-9-11-27-12-10-23/h5-6,13H,1-4,7-12,14H2,(H,20,21,24)