2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl-(2-methylphenyl)methyl]phenol

Systemtic Name: 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl-(2-methylphenyl)methyl]phenol Openeye Name: 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl-(o-tolyl)methyl]phenol CAS Name: 2-[[(3-methyl-1,2,4-oxadiazol-5-yl)methylthio]-(2-methylphenyl)methyl]phenol IUPAC Name: 2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl-(2-methylphenyl)methyl]phenol Traditional Name: 2-[[(3-methyl-1,2,4-oxadiazol-5-yl)methylthio]-(o-tolyl)methyl]phenol Formula: C18H18N2O2S MolecularWeight: 326.41272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C2=CC=CC=C2O)SCC3=NC(=NO3)C

Isomeric SMILES

CC1=CC=CC=C1C(C2=CC=CC=C2O)SCC3=NC(=NO3)C

InChI

InChI=1S/C18H18N2O2S/c1-12-7-3-4-8-14(12)18(15-9-5-6-10-16(15)21)23-11-17-19-13(2)20-22-17/h3-10,18,21H,11H2,1-2H3