ethyl 4-ethanoyl-5-methyl-2-[2-(4-nitrophenyl)sulfanylethanoylamino]furan-3-carboxylate

Systemtic Name: ethyl 4-ethanoyl-5-methyl-2-[2-(4-nitrophenyl)sulfanylethanoylamino]furan-3-carboxylate Openeye Name: ethyl 4-acetyl-5-methyl-2-[[2-(4-nitrophenyl)sulfanylacetyl]amino]furan-3-carboxylate CAS Name: 4-acetyl-5-methyl-2-[[2-[(4-nitrophenyl)thio]-1-oxoethyl]amino]-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 4-acetyl-5-methyl-2-[[2-(4-nitrophenyl)sulfanylacetyl]amino]furan-3-carboxylate Traditional Name: 4-acetyl-5-methyl-2-[[2-[(4-nitrophenyl)thio]acetyl]amino]furan-3-carboxylic acid ethyl ester Formula: C18H18N2O7S MolecularWeight: 406.40972

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1C(=O)C)C)NC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1C(=O)C)C)NC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O7S/c1-4-26-18(23)16-15(10(2)21)11(3)27-17(16)19-14(22)9-28-13-7-5-12(6-8-13)20(24)25/h5-8H,4,9H2,1-3H3,(H,19,22)