1-[4-[(2R)-3-(1,3-benzoxazol-2-ylsulfanyl)-2-oxidanyl-propoxy]phenyl]ethanone

Systemtic Name: 1-[4-[(2R)-3-(1,3-benzoxazol-2-ylsulfanyl)-2-oxidanyl-propoxy]phenyl]ethanone Openeye Name: 1-[4-[(2R)-3-(1,3-benzoxazol-2-ylsulfanyl)-2-hydroxy-propoxy]phenyl]ethanone CAS Name: 1-[4-[(2R)-3-(1,3-benzoxazol-2-ylthio)-2-hydroxypropoxy]phenyl]ethanone IUPAC Name: 1-[4-[(2R)-3-(1,3-benzoxazol-2-ylsulfanyl)-2-hydroxypropoxy]phenyl]ethanone Traditional Name: 1-[4-[(2R)-3-(1,3-benzoxazol-2-ylthio)-2-hydroxy-propoxy]phenyl]ethanone Formula: C18H17NO4S MolecularWeight: 343.39688

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OCC(CSC2=NC3=CC=CC=C3O2)O

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OC[C@H](CSC2=NC3=CC=CC=C3O2)O

InChI

InChI=1S/C18H17NO4S/c1-12(20)13-6-8-15(9-7-13)22-10-14(21)11-24-18-19-16-4-2-3-5-17(16)23-18/h2-9,14,21H,10-11H2,1H3/t14-/m1/s1