1-(3-methyl-2-phenylsulfanyl-imidazol-4-yl)propan-1-ol

Systemtic Name: 1-(3-methyl-2-phenylsulfanyl-imidazol-4-yl)propan-1-ol Openeye Name: 1-(3-methyl-2-phenylsulfanyl-imidazol-4-yl)propan-1-ol CAS Name: 1-[3-methyl-2-(phenylthio)-4-imidazolyl]-1-propanol IUPAC Name: 1-(3-methyl-2-phenylsulfanylimidazol-4-yl)propan-1-ol Traditional Name: 1-[3-methyl-2-(phenylthio)imidazol-4-yl]propan-1-ol Formula: C13H16N2OS MolecularWeight: 248.34394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CN=C(N1C)SC2=CC=CC=C2)O

Isomeric SMILES

CCC(C1=CN=C(N1C)SC2=CC=CC=C2)O

InChI

InChI=1S/C13H16N2OS/c1-3-12(16)11-9-14-13(15(11)2)17-10-7-5-4-6-8-10/h4-9,12,16H,3H2,1-2H3