(2S)-2-azaniumyl-3-[2-(cyclopropylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-propanoate

Systemtic Name: (2S)-2-azaniumyl-3-[2-(cyclopropylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-propanoate Openeye Name: (2S)-2-azaniumyl-3-[2-(cyclopropylmethylamino)-2-oxo-ethyl]sulfanyl-propanoate CAS Name: (2S)-2-ammonio-3-[[2-(cyclopropylmethylamino)-2-oxoethyl]thio]propanoate IUPAC Name: (2S)-2-azaniumyl-3-[2-(cyclopropylmethylamino)-2-oxoethyl]sulfanylpropanoate Traditional Name: (2S)-2-ammonio-3-[[2-(cyclopropylmethylamino)-2-keto-ethyl]thio]propionate Formula: C9H16N2O3S MolecularWeight: 232.29994

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CNC(=O)CSCC(C(=O)[O-])[NH3+]

Isomeric SMILES

C1CC1CNC(=O)CSC[C@H](C(=O)[O-])[NH3+]

InChI

InChI=1S/C9H16N2O3S/c10-7(9(13)14)4-15-5-8(12)11-3-6-1-2-6/h6-7H,1-5,10H2,(H,11,12)(H,13,14)/t7-/m1/s1