(2S,3R)-2-(1,3-benzothiazol-2-yl)-2-chloranyl-4-methyl-pentan-3-ol

Systemtic Name: (2S,3R)-2-(1,3-benzothiazol-2-yl)-2-chloranyl-4-methyl-pentan-3-ol Openeye Name: (2S,3R)-2-(1,3-benzothiazol-2-yl)-2-chloro-4-methyl-pentan-3-ol CAS Name: (2S,3R)-2-(1,3-benzothiazol-2-yl)-2-chloro-4-methyl-3-pentanol IUPAC Name: (2S,3R)-2-(1,3-benzothiazol-2-yl)-2-chloro-4-methylpentan-3-ol Traditional Name: (2S,3R)-2-(1,3-benzothiazol-2-yl)-2-chloro-4-methyl-pentan-3-ol Formula: C13H16ClNOS MolecularWeight: 269.79024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16ClNOS/c1-8(2)11(16)13(3,14)12-15-9-6-4-5-7-10(9)17-12/h4-8,11,16H,1-3H3/t11-,13+/m1/s1