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

Systemtic Name: 2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-(2-methylsulfonylphenyl)ethanamide Openeye Name: 2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-(2-methylsulfonylphenyl)acetamide CAS Name: 2-[(1-butyl-4,5-dimethyl-2-imidazolyl)thio]-N-(2-methylsulfonylphenyl)acetamide IUPAC Name: 2-(1-butyl-4,5-dimethylimidazol-2-yl)sulfanyl-N-(2-methylsulfonylphenyl)acetamide Traditional Name: 2-[(1-butyl-4,5-dimethyl-imidazol-2-yl)thio]-N-(2-mesylphenyl)acetamide Formula: C18H25N3O3S2 MolecularWeight: 395.5394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N=C1SCC(=O)NC2=CC=CC=C2S(=O)(=O)C)C)C

Isomeric SMILES

CCCCN1C(=C(N=C1SCC(=O)NC2=CC=CC=C2S(=O)(=O)C)C)C

InChI

InChI=1S/C18H25N3O3S2/c1-5-6-11-21-14(3)13(2)19-18(21)25-12-17(22)20-15-9-7-8-10-16(15)26(4,23)24/h7-10H,5-6,11-12H2,1-4H3,(H,20,22)