2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-(4-methylsulfonylphenyl)ethanone

Systemtic Name: 2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-(4-methylsulfonylphenyl)ethanone Openeye Name: 2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-(4-methylsulfonylphenyl)ethanone CAS Name: 2-[(1-butyl-4,5-dimethyl-2-imidazolyl)thio]-1-(4-methylsulfonylphenyl)ethanone IUPAC Name: 2-(1-butyl-4,5-dimethylimidazol-2-yl)sulfanyl-1-(4-methylsulfonylphenyl)ethanone Traditional Name: 2-[(1-butyl-4,5-dimethyl-imidazol-2-yl)thio]-1-(4-mesylphenyl)ethanone Formula: C18H24N2O3S2 MolecularWeight: 380.52476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N=C1SCC(=O)C2=CC=C(C=C2)S(=O)(=O)C)C)C

Isomeric SMILES

CCCCN1C(=C(N=C1SCC(=O)C2=CC=C(C=C2)S(=O)(=O)C)C)C

InChI

InChI=1S/C18H24N2O3S2/c1-5-6-11-20-14(3)13(2)19-18(20)24-12-17(21)15-7-9-16(10-8-15)25(4,22)23/h7-10H,5-6,11-12H2,1-4H3