1-[4-[3-[4,5-dimethyl-1-(2-methylpropyl)imidazol-2-yl]sulfanyl-2-oxidanyl-propoxy]phenyl]propan-1-one

Systemtic Name: 1-[4-[3-[4,5-dimethyl-1-(2-methylpropyl)imidazol-2-yl]sulfanyl-2-oxidanyl-propoxy]phenyl]propan-1-one Openeye Name: 1-[4-[2-hydroxy-3-(1-isobutyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-propoxy]phenyl]propan-1-one CAS Name: 1-[4-[3-[[4,5-dimethyl-1-(2-methylpropyl)-2-imidazolyl]thio]-2-hydroxypropoxy]phenyl]-1-propanone IUPAC Name: 1-[4-[3-[4,5-dimethyl-1-(2-methylpropyl)imidazol-2-yl]sulfanyl-2-hydroxypropoxy]phenyl]propan-1-one Traditional Name: 1-[4-[2-hydroxy-3-[(1-isobutyl-4,5-dimethyl-imidazol-2-yl)thio]propoxy]phenyl]propan-1-one Formula: C21H30N2O3S MolecularWeight: 390.5395

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC(CSC2=NC(=C(N2CC(C)C)C)C)O

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCC(CSC2=NC(=C(N2CC(C)C)C)C)O

InChI

InChI=1S/C21H30N2O3S/c1-6-20(25)17-7-9-19(10-8-17)26-12-18(24)13-27-21-22-15(4)16(5)23(21)11-14(2)3/h7-10,14,18,24H,6,11-13H2,1-5H3