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

Systemtic Name: 1-[4-[3-[4,5-dimethyl-1-(2-methylpropyl)imidazol-2-yl]sulfanyl-2-oxidanyl-propoxy]-3-methoxy-phenyl]ethanone Openeye Name: 1-[4-[2-hydroxy-3-(1-isobutyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-propoxy]-3-methoxy-phenyl]ethanone CAS Name: 1-[4-[3-[[4,5-dimethyl-1-(2-methylpropyl)-2-imidazolyl]thio]-2-hydroxypropoxy]-3-methoxyphenyl]ethanone IUPAC Name: 1-[4-[3-[4,5-dimethyl-1-(2-methylpropyl)imidazol-2-yl]sulfanyl-2-hydroxypropoxy]-3-methoxyphenyl]ethanone Traditional Name: 1-[4-[2-hydroxy-3-[(1-isobutyl-4,5-dimethyl-imidazol-2-yl)thio]propoxy]-3-methoxy-phenyl]ethanone Formula: C21H30N2O4S MolecularWeight: 406.5389

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SCC(COC2=C(C=C(C=C2)C(=O)C)OC)O)CC(C)C)C

Isomeric SMILES

CC1=C(N(C(=N1)SCC(COC2=C(C=C(C=C2)C(=O)C)OC)O)CC(C)C)C

InChI

InChI=1S/C21H30N2O4S/c1-13(2)10-23-15(4)14(3)22-21(23)28-12-18(25)11-27-19-8-7-17(16(5)24)9-20(19)26-6/h7-9,13,18,25H,10-12H2,1-6H3