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

Systemtic Name: 4-oxidanyl-7-[(1R)-1-oxidanyl-2-[3-(2-phenethyloxyethylsulfanyl)propylamino]ethyl]-3H-1,3-benzothiazol-2-one Openeye Name: 4-hydroxy-7-[(1R)-1-hydroxy-2-[3-(2-phenethyloxyethylsulfanyl)propylamino]ethyl]-3H-1,3-benzothiazol-2-one CAS Name: 4-hydroxy-7-[(1R)-1-hydroxy-2-[3-(2-phenethyloxyethylthio)propylamino]ethyl]-3H-1,3-benzothiazol-2-one IUPAC Name: 4-hydroxy-7-[(1R)-1-hydroxy-2-[3-(2-phenethyloxyethylsulfanyl)propylamino]ethyl]-3H-1,3-benzothiazol-2-one Traditional Name: 4-hydroxy-7-[(1R)-1-hydroxy-2-[3-(2-phenethyloxyethylthio)propylamino]ethyl]-3H-1,3-benzothiazol-2-one Formula: C22H28N2O4S2 MolecularWeight: 448.59872

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOCCSCCCNCC(C2=C3C(=C(C=C2)O)NC(=O)S3)O

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O4S2/c25-18-8-7-17(21-20(18)24-22(27)30-21)19(26)15-23-10-4-13-29-14-12-28-11-9-16-5-2-1-3-6-16/h1-3,5-8,19,23,25-26H,4,9-15H2,(H,24,27)/t19-/m0/s1