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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C(=O)N[C@@H](CCSC)C(=O)[O-]

InChI

InChI=1S/C12H22N2O3S/c1-9-3-6-14(7-4-9)12(17)13-10(11(15)16)5-8-18-2/h9-10H,3-8H2,1-2H3,(H,13,17)(H,15,16)/p-1/t10-/m0/s1