2-bromanyl-N-(6-morpholin-4-ylsulfonyl-1,3-benzothiazol-2-yl)hexanamide

Systemtic Name: 2-bromanyl-N-(6-morpholin-4-ylsulfonyl-1,3-benzothiazol-2-yl)hexanamide Openeye Name: 2-bromo-N-(6-morpholinosulfonyl-1,3-benzothiazol-2-yl)hexanamide CAS Name: 2-bromo-N-[6-(4-morpholinylsulfonyl)-1,3-benzothiazol-2-yl]hexanamide IUPAC Name: 2-bromo-N-(6-morpholin-4-ylsulfonyl-1,3-benzothiazol-2-yl)hexanamide Traditional Name: 2-bromo-N-(6-morpholinosulfonyl-1,3-benzothiazol-2-yl)hexanamide Formula: C17H22BrN3O4S2 MolecularWeight: 476.40828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)N3CCOCC3)Br

Isomeric SMILES

CCCCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)N3CCOCC3)Br

InChI

InChI=1S/C17H22BrN3O4S2/c1-2-3-4-13(18)16(22)20-17-19-14-6-5-12(11-15(14)26-17)27(23,24)21-7-9-25-10-8-21/h5-6,11,13H,2-4,7-10H2,1H3,(H,19,20,22)