1-[5-[(3,5-dimethylphenyl)sulfanyl-oxidanyl-methyl]-4-propan-2-yl-imidazol-1-yl]propan-2-one

Systemtic Name: 1-[5-[(3,5-dimethylphenyl)sulfanyl-oxidanyl-methyl]-4-propan-2-yl-imidazol-1-yl]propan-2-one Openeye Name: 1-[5-[(3,5-dimethylphenyl)sulfanyl-hydroxy-methyl]-4-isopropyl-imidazol-1-yl]propan-2-one CAS Name: 1-[5-[[(3,5-dimethylphenyl)thio]-hydroxymethyl]-4-propan-2-yl-1-imidazolyl]-2-propanone IUPAC Name: 1-[5-[(3,5-dimethylphenyl)sulfanyl-hydroxymethyl]-4-propan-2-ylimidazol-1-yl]propan-2-one Traditional Name: 1-[5-[[(3,5-dimethylphenyl)thio]-hydroxy-methyl]-4-isopropyl-imidazol-1-yl]acetone Formula: C18H24N2O2S MolecularWeight: 332.46036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)SC(C2=C(N=CN2CC(=O)C)C(C)C)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)SC(C2=C(N=CN2CC(=O)C)C(C)C)O)C

InChI

InChI=1S/C18H24N2O2S/c1-11(2)16-17(20(10-19-16)9-14(5)21)18(22)23-15-7-12(3)6-13(4)8-15/h6-8,10-11,18,22H,9H2,1-5H3