6-[(1,3-dimethyl-2H-imidazol-2-yl)sulfanyl]-5-oxidanylidene-N-phenethyl-hexanamide chloride

Systemtic Name: 6-[(1,3-dimethyl-2H-imidazol-2-yl)sulfanyl]-5-oxidanylidene-N-phenethyl-hexanamide chloride Openeye Name: 6-[(1,3-dimethyl-2H-imidazol-2-yl)sulfanyl]-5-oxo-N-phenethyl-hexanamide chloride CAS Name: 6-[(1,3-dimethyl-2H-imidazol-2-yl)thio]-5-oxo-N-phenethylhexanamide chloride IUPAC Name: 6-[(1,3-dimethyl-2H-imidazol-2-yl)sulfanyl]-5-oxo-N-phenethylhexanamide chloride Traditional Name: 6-[(1,3-dimethyl-4-imidazolin-2-yl)thio]-5-keto-N-phenethyl-hexanamide chloride Formula: C19H27ClN3O2S- MolecularWeight: 396.95458

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN(C1SCC(=O)CCCC(=O)NCCC2=CC=CC=C2)C.[Cl-]

Isomeric SMILES

CN1C=CN(C1SCC(=O)CCCC(=O)NCCC2=CC=CC=C2)C.[Cl-]

InChI

InChI=1S/C19H27N3O2S.ClH/c1-21-13-14-22(2)19(21)25-15-17(23)9-6-10-18(24)20-12-11-16-7-4-3-5-8-16;/h3-5,7-8,13-14,19H,6,9-12,15H2,1-2H3,(H,20,24);1H/p-1