(2R)-1-(1,3-benzoxazol-2-ylsulfanyl)-3-(2,3,6-trimethylphenoxy)propan-2-ol

Systemtic Name: (2R)-1-(1,3-benzoxazol-2-ylsulfanyl)-3-(2,3,6-trimethylphenoxy)propan-2-ol Openeye Name: (2R)-1-(1,3-benzoxazol-2-ylsulfanyl)-3-(2,3,6-trimethylphenoxy)propan-2-ol CAS Name: (2R)-1-(1,3-benzoxazol-2-ylthio)-3-(2,3,6-trimethylphenoxy)-2-propanol IUPAC Name: (2R)-1-(1,3-benzoxazol-2-ylsulfanyl)-3-(2,3,6-trimethylphenoxy)propan-2-ol Traditional Name: (2R)-1-(1,3-benzoxazol-2-ylthio)-3-(2,3,6-trimethylphenoxy)propan-2-ol Formula: C19H21NO3S MolecularWeight: 343.43994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OCC(CSC2=NC3=CC=CC=C3O2)O)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OC[C@H](CSC2=NC3=CC=CC=C3O2)O)C

InChI

InChI=1S/C19H21NO3S/c1-12-8-9-13(2)18(14(12)3)22-10-15(21)11-24-19-20-16-6-4-5-7-17(16)23-19/h4-9,15,21H,10-11H2,1-3H3/t15-/m1/s1