(1S,2S)-1-(benzotriazol-1-yl)-1-methylsulfanyl-2-(1,3-thiazol-2-yl)propan-2-ol

Systemtic Name: (1S,2S)-1-(benzotriazol-1-yl)-1-methylsulfanyl-2-(1,3-thiazol-2-yl)propan-2-ol Openeye Name: (1S,2S)-1-(benzotriazol-1-yl)-1-methylsulfanyl-2-thiazol-2-yl-propan-2-ol CAS Name: (1S,2S)-1-(1-benzotriazolyl)-1-(methylthio)-2-(2-thiazolyl)-2-propanol IUPAC Name: (1S,2S)-1-(benzotriazol-1-yl)-1-methylsulfanyl-2-(1,3-thiazol-2-yl)propan-2-ol Traditional Name: (1S,2S)-1-(benzotriazol-1-yl)-1-(methylthio)-2-thiazol-2-yl-propan-2-ol Formula: C13H14N4OS2 MolecularWeight: 306.40646

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC=CS1)(C(N2C3=CC=CC=C3N=N2)SC)O

Isomeric SMILES

C[C@@](C1=NC=CS1)([C@@H](N2C3=CC=CC=C3N=N2)SC)O

InChI

InChI=1S/C13H14N4OS2/c1-13(18,11-14-7-8-20-11)12(19-2)17-10-6-4-3-5-9(10)15-16-17/h3-8,12,18H,1-2H3/t12-,13+/m0/s1