ethyl 4-ethanoyl-5-methyl-2-[2-(phenylmethylsulfanyl)ethanoylamino]furan-3-carboxylate

Systemtic Name: ethyl 4-ethanoyl-5-methyl-2-[2-(phenylmethylsulfanyl)ethanoylamino]furan-3-carboxylate Openeye Name: ethyl 4-acetyl-2-[(2-benzylsulfanylacetyl)amino]-5-methyl-furan-3-carboxylate CAS Name: 4-acetyl-5-methyl-2-[[1-oxo-2-(phenylmethylthio)ethyl]amino]-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 4-acetyl-2-[(2-benzylsulfanylacetyl)amino]-5-methylfuran-3-carboxylate Traditional Name: 4-acetyl-2-[[2-(benzylthio)acetyl]amino]-5-methyl-furan-3-carboxylic acid ethyl ester Formula: C19H21NO5S MolecularWeight: 375.43874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1C(=O)C)C)NC(=O)CSCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1C(=O)C)C)NC(=O)CSCC2=CC=CC=C2

InChI

InChI=1S/C19H21NO5S/c1-4-24-19(23)17-16(12(2)21)13(3)25-18(17)20-15(22)11-26-10-14-8-6-5-7-9-14/h5-9H,4,10-11H2,1-3H3,(H,20,22)