ethyl 4-ethanoyl-5-methyl-2-(2-pyrimidin-2-ylsulfanylethanoylamino)furan-3-carboxylate

Systemtic Name: ethyl 4-ethanoyl-5-methyl-2-(2-pyrimidin-2-ylsulfanylethanoylamino)furan-3-carboxylate Openeye Name: ethyl 4-acetyl-5-methyl-2-[(2-pyrimidin-2-ylsulfanylacetyl)amino]furan-3-carboxylate CAS Name: 4-acetyl-5-methyl-2-[[1-oxo-2-(2-pyrimidinylthio)ethyl]amino]-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 4-acetyl-5-methyl-2-[(2-pyrimidin-2-ylsulfanylacetyl)amino]furan-3-carboxylate Traditional Name: 4-acetyl-5-methyl-2-[[2-(2-pyrimidylthio)acetyl]amino]furan-3-carboxylic acid ethyl ester Formula: C16H17N3O5S MolecularWeight: 363.38828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1C(=O)C)C)NC(=O)CSC2=NC=CC=N2

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1C(=O)C)C)NC(=O)CSC2=NC=CC=N2

InChI

InChI=1S/C16H17N3O5S/c1-4-23-15(22)13-12(9(2)20)10(3)24-14(13)19-11(21)8-25-16-17-6-5-7-18-16/h5-7H,4,8H2,1-3H3,(H,19,21)