(2R)-2-[[(1S,2S)-2-methylcyclohexyl]carbamoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2R)-2-[[(1S,2S)-2-methylcyclohexyl]carbamoylamino]-4-methylsulfanyl-butanoate Openeye Name: (2R)-2-[[(1S,2S)-2-methylcyclohexyl]carbamoylamino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[[[(1S,2S)-2-methylcyclohexyl]amino]-oxomethyl]amino]-4-(methylthio)butanoate IUPAC Name: (2R)-2-[[(1S,2S)-2-methylcyclohexyl]carbamoylamino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[[(1S,2S)-2-methylcyclohexyl]carbamoylamino]-4-(methylthio)butyrate Formula: C13H23N2O3S- MolecularWeight: 287.39832

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=O)N[C@H](CCSC)C(=O)[O-]

InChI

InChI=1S/C13H24N2O3S/c1-9-5-3-4-6-10(9)14-13(18)15-11(12(16)17)7-8-19-2/h9-11H,3-8H2,1-2H3,(H,16,17)(H2,14,15,18)/p-1/t9-,10-,11+/m0/s1