[2,5-bis(oxidanylidene)pyrrolidin-1-yl] 3-(2-pyrimidin-2-ylsulfanylethanoylamino)propanoate

Systemtic Name: [2,5-bis(oxidanylidene)pyrrolidin-1-yl] 3-(2-pyrimidin-2-ylsulfanylethanoylamino)propanoate Openeye Name: (2,5-dioxopyrrolidin-1-yl) 3-[(2-pyrimidin-2-ylsulfanylacetyl)amino]propanoate CAS Name: 3-[[1-oxo-2-(2-pyrimidinylthio)ethyl]amino]propanoic acid (2,5-dioxo-1-pyrrolidinyl) ester IUPAC Name: (2,5-dioxopyrrolidin-1-yl) 3-[(2-pyrimidin-2-ylsulfanylacetyl)amino]propanoate Traditional Name: 3-[[2-(2-pyrimidylthio)acetyl]amino]propionic acid succinimido ester Formula: C13H14N4O5S MolecularWeight: 338.33906

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1=O)OC(=O)CCNC(=O)CSC2=NC=CC=N2

Isomeric SMILES

C1CC(=O)N(C1=O)OC(=O)CCNC(=O)CSC2=NC=CC=N2

InChI

InChI=1S/C13H14N4O5S/c18-9(8-23-13-15-5-1-6-16-13)14-7-4-12(21)22-17-10(19)2-3-11(17)20/h1,5-6H,2-4,7-8H2,(H,14,18)