(5S)-2-butanoyl-5-[(2R)-2-ethylsulfanylpropyl]-3-methylimino-cyclohexan-1-one

Systemtic Name: (5S)-2-butanoyl-5-[(2R)-2-ethylsulfanylpropyl]-3-methylimino-cyclohexan-1-one Openeye Name: (5S)-2-butanoyl-5-[(2R)-2-ethylsulfanylpropyl]-3-methylimino-cyclohexanone CAS Name: (5S)-5-[(2R)-2-(ethylthio)propyl]-3-methylimino-2-(1-oxobutyl)-1-cyclohexanone IUPAC Name: (5S)-2-butanoyl-5-[(2R)-2-ethylsulfanylpropyl]-3-methyliminocyclohexan-1-one Traditional Name: (5S)-2-butyryl-5-[(2R)-2-(ethylthio)propyl]-3-methylimino-cyclohexanone Formula: C16H27NO2S MolecularWeight: 297.45608

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1C(=NC)CC(CC1=O)CC(C)SCC

Isomeric SMILES

CCCC(=O)C1C(=NC)C[C@@H](CC1=O)C[C@@H](C)SCC

InChI

InChI=1S/C16H27NO2S/c1-5-7-14(18)16-13(17-4)9-12(10-15(16)19)8-11(3)20-6-2/h11-12,16H,5-10H2,1-4H3/t11-,12+,16?/m1/s1