(2S)-2-[[(3S)-3-methylpiperidin-1-yl]carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-[[(3S)-3-methylpiperidin-1-yl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-[[(3S)-3-methylpiperidine-1-carbonyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[[(3S)-3-methyl-1-piperidinyl]-oxomethyl]amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-[[(3S)-3-methylpiperidine-1-carbonyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[[(3S)-3-methylpiperidine-1-carbonyl]amino]-4-(methylthio)butyrate Formula: C12H21N2O3S- MolecularWeight: 273.37174

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

C[C@H]1CCCN(C1)C(=O)N[C@@H](CCSC)C(=O)[O-]

InChI

InChI=1S/C12H22N2O3S/c1-9-4-3-6-14(8-9)12(17)13-10(11(15)16)5-7-18-2/h9-10H,3-8H2,1-2H3,(H,13,17)(H,15,16)/p-1/t9-,10-/m0/s1