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

Systemtic Name: ethyl 2-[2-[3-(4-chlorophenyl)sulfanylpropanoyloxy]ethanoylamino]-4-ethanoyl-5-methyl-furan-3-carboxylate Openeye Name: ethyl 4-acetyl-2-[[2-[3-(4-chlorophenyl)sulfanylpropanoyloxy]acetyl]amino]-5-methyl-furan-3-carboxylate CAS Name: 4-acetyl-2-[[2-[3-[(4-chlorophenyl)thio]-1-oxopropoxy]-1-oxoethyl]amino]-5-methyl-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 4-acetyl-2-[[2-[3-(4-chlorophenyl)sulfanylpropanoyloxy]acetyl]amino]-5-methylfuran-3-carboxylate Traditional Name: 4-acetyl-2-[[2-[3-[(4-chlorophenyl)thio]propanoyloxy]acetyl]amino]-5-methyl-furan-3-carboxylic acid ethyl ester Formula: C21H22ClNO7S MolecularWeight: 467.91988

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1C(=O)C)C)NC(=O)COC(=O)CCSC2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1C(=O)C)C)NC(=O)COC(=O)CCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H22ClNO7S/c1-4-28-21(27)19-18(12(2)24)13(3)30-20(19)23-16(25)11-29-17(26)9-10-31-15-7-5-14(22)6-8-15/h5-8H,4,9-11H2,1-3H3,(H,23,25)