(2S)-2-azanyl-N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-4-methylsulfonyl-butanamide

Systemtic Name: (2S)-2-azanyl-N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-4-methylsulfonyl-butanamide Openeye Name: (2S)-2-amino-N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-4-methylsulfonyl-butanamide CAS Name: (2S)-2-amino-N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-4-methylsulfonylbutanamide IUPAC Name: (2S)-2-amino-N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-4-methylsulfonylbutanamide Traditional Name: (2S)-2-amino-N-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-4-mesyl-butyramide Formula: C13H26N2O3S MolecularWeight: 290.42214

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)C(CCS(=O)(=O)C)N

Isomeric SMILES

C[C@H]1CCC[C@@H]([C@@H]1C)NC(=O)[C@H](CCS(=O)(=O)C)N

InChI

InChI=1S/C13H26N2O3S/c1-9-5-4-6-12(10(9)2)15-13(16)11(14)7-8-19(3,17)18/h9-12H,4-8,14H2,1-3H3,(H,15,16)/t9-,10+,11-,12-/m0/s1