2-azanyl-3-[2-oxidanylidene-2-(1H-pyrrol-2-ylcarbonylamino)ethyl]sulfanyl-propanoic acid

Systemtic Name: 2-azanyl-3-[2-oxidanylidene-2-(1H-pyrrol-2-ylcarbonylamino)ethyl]sulfanyl-propanoic acid Openeye Name: 2-amino-3-[2-oxo-2-(1H-pyrrole-2-carbonylamino)ethyl]sulfanyl-propanoic acid CAS Name: 2-amino-3-[[2-oxo-2-[[oxo(1H-pyrrol-2-yl)methyl]amino]ethyl]thio]propanoic acid IUPAC Name: 2-amino-3-[2-oxo-2-(1H-pyrrole-2-carbonylamino)ethyl]sulfanylpropanoic acid Traditional Name: 2-amino-3-[[2-keto-2-(1H-pyrrole-2-carbonylamino)ethyl]thio]propionic acid Formula: C10H13N3O4S MolecularWeight: 271.29292

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Descriptors Computed from Structure

Canonical SMILES:

C1=CNC(=C1)C(=O)NC(=O)CSCC(C(=O)O)N

Isomeric SMILES

C1=CNC(=C1)C(=O)NC(=O)CSCC(C(=O)O)N

InChI

InChI=1S/C10H13N3O4S/c11-6(10(16)17)4-18-5-8(14)13-9(15)7-2-1-3-12-7/h1-3,6,12H,4-5,11H2,(H,16,17)(H,13,14,15)