3-[2-[(1-methylpyrrol-2-yl)carbonylamino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid

Systemtic Name: 3-[2-[(1-methylpyrrol-2-yl)carbonylamino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: 3-[2-[(1-methylpyrrole-2-carbonyl)amino]-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 3-[[2-[[(1-methyl-2-pyrrolyl)-oxomethyl]amino]-2-oxoethyl]thio]propanoic acid IUPAC Name: 3-[2-[(1-methylpyrrole-2-carbonyl)amino]-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 3-[[2-keto-2-[(1-methylpyrrole-2-carbonyl)amino]ethyl]thio]propionic acid Formula: C11H14N2O4S MolecularWeight: 270.30486

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)NC(=O)CSCCC(=O)O

Isomeric SMILES

CN1C=CC=C1C(=O)NC(=O)CSCCC(=O)O

InChI

InChI=1S/C11H14N2O4S/c1-13-5-2-3-8(13)11(17)12-9(14)7-18-6-4-10(15)16/h2-3,5H,4,6-7H2,1H3,(H,15,16)(H,12,14,17)