(2-morpholin-4-yl-2-oxidanylidene-ethyl) 2-[2-[(5-bromanylpyridin-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-ethyl) 2-[2-[(5-bromanylpyridin-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: (2-morpholino-2-oxo-ethyl) 2-[2-[(5-bromo-2-pyridyl)amino]-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-[(5-bromo-2-pyridinyl)amino]-2-oxoethyl]thio]acetic acid [2-(4-morpholinyl)-2-oxoethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxoethyl) 2-[2-[(5-bromopyridin-2-yl)amino]-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-[(5-bromo-2-pyridyl)amino]-2-keto-ethyl]thio]acetic acid (2-keto-2-morpholino-ethyl) ester Formula: C15H18BrN3O5S MolecularWeight: 432.28952

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)COC(=O)CSCC(=O)NC2=NC=C(C=C2)Br

Isomeric SMILES

C1COCCN1C(=O)COC(=O)CSCC(=O)NC2=NC=C(C=C2)Br

InChI

InChI=1S/C15H18BrN3O5S/c16-11-1-2-12(17-7-11)18-13(20)9-25-10-15(22)24-8-14(21)19-3-5-23-6-4-19/h1-2,7H,3-6,8-10H2,(H,17,18,20)