2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)ethanone

Systemtic Name: 2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)ethanone Openeye Name: 2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-1-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)ethanone CAS Name: 2-[(1-butyl-4,5-dimethyl-2-imidazolyl)thio]-1-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)ethanone IUPAC Name: 2-(1-butyl-4,5-dimethylimidazol-2-yl)sulfanyl-1-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)ethanone Traditional Name: 2-[(1-butyl-4,5-dimethyl-imidazol-2-yl)thio]-1-(1-mesyl-3,4-dihydro-2H-quinolin-6-yl)ethanone Formula: C21H29N3O3S2 MolecularWeight: 435.60326

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N=C1SCC(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C)C)C

Isomeric SMILES

CCCCN1C(=C(N=C1SCC(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C)C)C

InChI

InChI=1S/C21H29N3O3S2/c1-5-6-11-23-16(3)15(2)22-21(23)28-14-20(25)18-9-10-19-17(13-18)8-7-12-24(19)29(4,26)27/h9-10,13H,5-8,11-12,14H2,1-4H3