(2S)-2-[(4-pyrrolidin-1-ylsulfonylthiophen-2-yl)carbonylamino]propanoate

Systemtic Name: (2S)-2-[(4-pyrrolidin-1-ylsulfonylthiophen-2-yl)carbonylamino]propanoate Openeye Name: (2S)-2-[(4-pyrrolidin-1-ylsulfonylthiophene-2-carbonyl)amino]propanoate CAS Name: (2S)-2-[[oxo-[4-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methyl]amino]propanoate IUPAC Name: (2S)-2-[(4-pyrrolidin-1-ylsulfonylthiophene-2-carbonyl)amino]propanoate Traditional Name: (2S)-2-[(4-pyrrolidinosulfonylthiophene-2-carbonyl)amino]propionate Formula: C12H15N2O5S2- MolecularWeight: 331.3879

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])NC(=O)C1=CC(=CS1)S(=O)(=O)N2CCCC2

Isomeric SMILES

C[C@@H](C(=O)[O-])NC(=O)C1=CC(=CS1)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C12H16N2O5S2/c1-8(12(16)17)13-11(15)10-6-9(7-20-10)21(18,19)14-4-2-3-5-14/h6-8H,2-5H2,1H3,(H,13,15)(H,16,17)/p-1/t8-/m0/s1