3-(1H-imidazol-5-yl)-3-[(4-methoxyphenyl)methylsulfanyl]propan-1-ol

Systemtic Name: 3-(1H-imidazol-5-yl)-3-[(4-methoxyphenyl)methylsulfanyl]propan-1-ol Openeye Name: 3-(1H-imidazol-5-yl)-3-[(4-methoxyphenyl)methylsulfanyl]propan-1-ol CAS Name: 3-(1H-imidazol-5-yl)-3-[(4-methoxyphenyl)methylthio]-1-propanol IUPAC Name: 3-(1H-imidazol-5-yl)-3-[(4-methoxyphenyl)methylsulfanyl]propan-1-ol Traditional Name: 3-(1H-imidazol-5-yl)-3-(p-anisylthio)propan-1-ol Formula: C14H18N2O2S MolecularWeight: 278.36992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CSC(CCO)C2=CN=CN2

Isomeric SMILES

COC1=CC=C(C=C1)CSC(CCO)C2=CN=CN2

InChI

InChI=1S/C14H18N2O2S/c1-18-12-4-2-11(3-5-12)9-19-14(6-7-17)13-8-15-10-16-13/h2-5,8,10,14,17H,6-7,9H2,1H3,(H,15,16)