(2S,3R)-2-(1,3-benzothiazol-2-yl)hex-4-yn-3-ol

Systemtic Name: (2S,3R)-2-(1,3-benzothiazol-2-yl)hex-4-yn-3-ol Openeye Name: (2S,3R)-2-(1,3-benzothiazol-2-yl)hex-4-yn-3-ol CAS Name: (2S,3R)-2-(1,3-benzothiazol-2-yl)-4-hexyn-3-ol IUPAC Name: (2S,3R)-2-(1,3-benzothiazol-2-yl)hex-4-yn-3-ol Traditional Name: (2S,3R)-2-(1,3-benzothiazol-2-yl)hex-4-yn-3-ol Formula: C13H13NOS MolecularWeight: 231.31342

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC(C(C)C1=NC2=CC=CC=C2S1)O

Isomeric SMILES

CC#C[C@@H]([C@H](C)C1=NC2=CC=CC=C2S1)O

InChI

InChI=1S/C13H13NOS/c1-3-6-11(15)9(2)13-14-10-7-4-5-8-12(10)16-13/h4-5,7-9,11,15H,1-2H3/t9-,11-/m0/s1