methyl 5-[[2-[[4-(diethylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanylmethyl]-2-methyl-furan-3-carboxylate

Systemtic Name: methyl 5-[[2-[[4-(diethylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanylmethyl]-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-[[2-[4-(diethylcarbamoyl)anilino]-2-oxo-ethyl]sulfanylmethyl]-2-methyl-furan-3-carboxylate CAS Name: 5-[[[2-[4-[diethylamino(oxo)methyl]anilino]-2-oxoethyl]thio]methyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[2-[4-(diethylcarbamoyl)anilino]-2-oxoethyl]sulfanylmethyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[[[2-[4-(diethylcarbamoyl)anilino]-2-keto-ethyl]thio]methyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)CSCC2=CC(=C(O2)C)C(=O)OC

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)CSCC2=CC(=C(O2)C)C(=O)OC

InChI

InChI=1S/C21H26N2O5S/c1-5-23(6-2)20(25)15-7-9-16(10-8-15)22-19(24)13-29-12-17-11-18(14(3)28-17)21(26)27-4/h7-11H,5-6,12-13H2,1-4H3,(H,22,24)