(2S)-1-(1,3-benzoxazol-2-ylsulfanyl)-3-(4-bromanylphenoxy)propan-2-ol

Systemtic Name: (2S)-1-(1,3-benzoxazol-2-ylsulfanyl)-3-(4-bromanylphenoxy)propan-2-ol Openeye Name: (2S)-1-(1,3-benzoxazol-2-ylsulfanyl)-3-(4-bromophenoxy)propan-2-ol CAS Name: (2S)-1-(1,3-benzoxazol-2-ylthio)-3-(4-bromophenoxy)-2-propanol IUPAC Name: (2S)-1-(1,3-benzoxazol-2-ylsulfanyl)-3-(4-bromophenoxy)propan-2-ol Traditional Name: (2S)-1-(1,3-benzoxazol-2-ylthio)-3-(4-bromophenoxy)propan-2-ol Formula: C16H14BrNO3S MolecularWeight: 380.25626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)SCC(COC3=CC=C(C=C3)Br)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)SC[C@H](COC3=CC=C(C=C3)Br)O

InChI

InChI=1S/C16H14BrNO3S/c17-11-5-7-13(8-6-11)20-9-12(19)10-22-16-18-14-3-1-2-4-15(14)21-16/h1-8,12,19H,9-10H2/t12-/m0/s1