7-[(1R)-2-[3-[3-[2-(4-bromophenyl)ethoxy]propylsulfanyl]propylamino]-1-oxidanyl-ethyl]-4-oxidanyl-3H-1,3-benzothiazol-2-one

Systemtic Name: 7-[(1R)-2-[3-[3-[2-(4-bromophenyl)ethoxy]propylsulfanyl]propylamino]-1-oxidanyl-ethyl]-4-oxidanyl-3H-1,3-benzothiazol-2-one Openeye Name: 7-[(1R)-2-[3-[3-[2-(4-bromophenyl)ethoxy]propylsulfanyl]propylamino]-1-hydroxy-ethyl]-4-hydroxy-3H-1,3-benzothiazol-2-one CAS Name: 7-[(1R)-2-[3-[3-[2-(4-bromophenyl)ethoxy]propylthio]propylamino]-1-hydroxyethyl]-4-hydroxy-3H-1,3-benzothiazol-2-one IUPAC Name: 7-[(1R)-2-[3-[3-[2-(4-bromophenyl)ethoxy]propylsulfanyl]propylamino]-1-hydroxyethyl]-4-hydroxy-3H-1,3-benzothiazol-2-one Traditional Name: 7-[(1R)-2-[3-[3-[2-(4-bromophenyl)ethoxy]propylthio]propylamino]-1-hydroxy-ethyl]-4-hydroxy-3H-1,3-benzothiazol-2-one Formula: C23H29BrN2O4S2 MolecularWeight: 541.52136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCOCCCSCCCNCC(C2=C3C(=C(C=C2)O)NC(=O)S3)O)Br

Isomeric SMILES

C1=CC(=CC=C1CCOCCCSCCCNC[C@@H](C2=C3C(=C(C=C2)O)NC(=O)S3)O)Br

InChI

InChI=1S/C23H29BrN2O4S2/c24-17-5-3-16(4-6-17)9-12-30-11-2-14-31-13-1-10-25-15-20(28)18-7-8-19(27)21-22(18)32-23(29)26-21/h3-8,20,25,27-28H,1-2,9-15H2,(H,26,29)/t20-/m0/s1