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

Systemtic Name: (5S)-3-azanylidene-2-butanoyl-5-[(2R)-2-ethylsulfanylpropyl]cyclohexan-1-one Openeye Name: (5S)-2-butanoyl-5-[(2R)-2-ethylsulfanylpropyl]-3-imino-cyclohexanone CAS Name: (5S)-5-[(2R)-2-(ethylthio)propyl]-3-imino-2-(1-oxobutyl)-1-cyclohexanone IUPAC Name: (5S)-2-butanoyl-5-[(2R)-2-ethylsulfanylpropyl]-3-iminocyclohexan-1-one Traditional Name: (5S)-2-butyryl-5-[(2R)-2-(ethylthio)propyl]-3-imino-cyclohexanone Formula: C15H25NO2S MolecularWeight: 283.4295

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H25NO2S/c1-4-6-13(17)15-12(16)8-11(9-14(15)18)7-10(3)19-5-2/h10-11,15-16H,4-9H2,1-3H3/t10-,11+,15?/m1/s1