diethyl-[(1R)-1-(furan-2-yl)-2-(2-pyrimidin-2-ylsulfanylethanoylamino)ethyl]azanium

Systemtic Name: diethyl-[(1R)-1-(furan-2-yl)-2-(2-pyrimidin-2-ylsulfanylethanoylamino)ethyl]azanium Openeye Name: diethyl-[(1R)-1-(2-furyl)-2-[(2-pyrimidin-2-ylsulfanylacetyl)amino]ethyl]ammonium CAS Name: diethyl-[(1R)-1-(2-furanyl)-2-[[1-oxo-2-(2-pyrimidinylthio)ethyl]amino]ethyl]ammonium IUPAC Name: diethyl-[(1R)-1-(furan-2-yl)-2-[(2-pyrimidin-2-ylsulfanylacetyl)amino]ethyl]azanium Traditional Name: diethyl-[(1R)-1-(2-furyl)-2-[[2-(2-pyrimidylthio)acetyl]amino]ethyl]ammonium Formula: C16H23N4O2S+ MolecularWeight: 335.44442

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(CNC(=O)CSC1=NC=CC=N1)C2=CC=CO2

Isomeric SMILES

CC[NH+](CC)[C@H](CNC(=O)CSC1=NC=CC=N1)C2=CC=CO2

InChI

InChI=1S/C16H22N4O2S/c1-3-20(4-2)13(14-7-5-10-22-14)11-19-15(21)12-23-16-17-8-6-9-18-16/h5-10,13H,3-4,11-12H2,1-2H3,(H,19,21)/p+1/t13-/m1/s1