1-imidazol-1-yl-3-(phenylmethylsulfanyl)propan-2-ol

Systemtic Name: 1-imidazol-1-yl-3-(phenylmethylsulfanyl)propan-2-ol Openeye Name: 1-benzylsulfanyl-3-imidazol-1-yl-propan-2-ol CAS Name: 1-(1-imidazolyl)-3-(phenylmethylthio)-2-propanol IUPAC Name: 1-benzylsulfanyl-3-imidazol-1-ylpropan-2-ol Traditional Name: 1-(benzylthio)-3-imidazol-1-yl-propan-2-ol Formula: C13H16N2OS MolecularWeight: 248.34394

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC(CN2C=CN=C2)O

Isomeric SMILES

C1=CC=C(C=C1)CSCC(CN2C=CN=C2)O

InChI

InChI=1S/C13H16N2OS/c16-13(8-15-7-6-14-11-15)10-17-9-12-4-2-1-3-5-12/h1-7,11,13,16H,8-10H2