2-[2-(5-bromanylpentoxy)-5-methoxy-phenyl]-2,4-dimethyl-1,4-benzothiazin-3-one

Systemtic Name: 2-[2-(5-bromanylpentoxy)-5-methoxy-phenyl]-2,4-dimethyl-1,4-benzothiazin-3-one Openeye Name: 2-[2-(5-bromopentoxy)-5-methoxy-phenyl]-2,4-dimethyl-1,4-benzothiazin-3-one CAS Name: 2-[2-(5-bromopentoxy)-5-methoxyphenyl]-2,4-dimethyl-1,4-benzothiazin-3-one IUPAC Name: 2-[2-(5-bromopentoxy)-5-methoxyphenyl]-2,4-dimethyl-1,4-benzothiazin-3-one Traditional Name: 2-[2-(5-bromopentoxy)-5-methoxy-phenyl]-2,4-dimethyl-1,4-benzothiazin-3-one Formula: C22H26BrNO3S MolecularWeight: 464.41574

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C2=CC=CC=C2S1)C)C3=C(C=CC(=C3)OC)OCCCCCBr

Isomeric SMILES

CC1(C(=O)N(C2=CC=CC=C2S1)C)C3=C(C=CC(=C3)OC)OCCCCCBr

InChI

InChI=1S/C22H26BrNO3S/c1-22(21(25)24(2)18-9-5-6-10-20(18)28-22)17-15-16(26-3)11-12-19(17)27-14-8-4-7-13-23/h5-6,9-12,15H,4,7-8,13-14H2,1-3H3