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

Systemtic Name: ethyl 4-ethanoyl-5-methyl-2-[2-[(2-methylphenyl)methylsulfanyl]ethanoylamino]furan-3-carboxylate Openeye Name: ethyl 4-acetyl-5-methyl-2-[[2-(o-tolylmethylsulfanyl)acetyl]amino]furan-3-carboxylate CAS Name: 4-acetyl-5-methyl-2-[[2-[(2-methylphenyl)methylthio]-1-oxoethyl]amino]-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 4-acetyl-5-methyl-2-[[2-[(2-methylphenyl)methylsulfanyl]acetyl]amino]furan-3-carboxylate Traditional Name: 4-acetyl-5-methyl-2-[[2-[(2-methylbenzyl)thio]acetyl]amino]furan-3-carboxylic acid ethyl ester Formula: C20H23NO5S MolecularWeight: 389.46532

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1C(=O)C)C)NC(=O)CSCC2=CC=CC=C2C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1C(=O)C)C)NC(=O)CSCC2=CC=CC=C2C

InChI

InChI=1S/C20H23NO5S/c1-5-25-20(24)18-17(13(3)22)14(4)26-19(18)21-16(23)11-27-10-15-9-7-6-8-12(15)2/h6-9H,5,10-11H2,1-4H3,(H,21,23)