2-(4-bromanylbutyl)-2-[5-methoxy-2-(oxan-2-yloxy)phenyl]-4-methyl-1,4-benzothiazin-3-one

Systemtic Name: 2-(4-bromanylbutyl)-2-[5-methoxy-2-(oxan-2-yloxy)phenyl]-4-methyl-1,4-benzothiazin-3-one Openeye Name: 2-(4-bromobutyl)-2-(5-methoxy-2-tetrahydropyran-2-yloxy-phenyl)-4-methyl-1,4-benzothiazin-3-one CAS Name: 2-(4-bromobutyl)-2-[5-methoxy-2-(2-oxanyloxy)phenyl]-4-methyl-1,4-benzothiazin-3-one IUPAC Name: 2-(4-bromobutyl)-2-[5-methoxy-2-(oxan-2-yloxy)phenyl]-4-methyl-1,4-benzothiazin-3-one Traditional Name: 2-(4-bromobutyl)-2-(5-methoxy-2-tetrahydropyran-2-yloxy-phenyl)-4-methyl-1,4-benzothiazin-3-one Formula: C25H30BrNO4S MolecularWeight: 520.479

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2SC(C1=O)(CCCCBr)C3=C(C=CC(=C3)OC)OC4CCCCO4

Isomeric SMILES

CN1C2=CC=CC=C2SC(C1=O)(CCCCBr)C3=C(C=CC(=C3)OC)OC4CCCCO4

InChI

InChI=1S/C25H30BrNO4S/c1-27-20-9-3-4-10-22(20)32-25(24(27)28,14-6-7-15-26)19-17-18(29-2)12-13-21(19)31-23-11-5-8-16-30-23/h3-4,9-10,12-13,17,23H,5-8,11,14-16H2,1-2H3