(2-oxidanylidene-2-piperidin-1-yl-ethyl) 2-[2-[(5-bromanylpyridin-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: (2-oxidanylidene-2-piperidin-1-yl-ethyl) 2-[2-[(5-bromanylpyridin-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: [2-oxo-2-(1-piperidyl)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-oxo-2-(1-piperidinyl)ethyl] ester IUPAC Name: (2-oxo-2-piperidin-1-ylethyl) 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-piperidino-ethyl) ester Formula: C16H20BrN3O4S MolecularWeight: 430.3167

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)COC(=O)CSCC(=O)NC2=NC=C(C=C2)Br

Isomeric SMILES

C1CCN(CC1)C(=O)COC(=O)CSCC(=O)NC2=NC=C(C=C2)Br

InChI

InChI=1S/C16H20BrN3O4S/c17-12-4-5-13(18-8-12)19-14(21)10-25-11-16(23)24-9-15(22)20-6-2-1-3-7-20/h4-5,8H,1-3,6-7,9-11H2,(H,18,19,21)