ethyl 4,5-dimethyl-2-[2-[4-(4-methylsulfanylphenyl)-4-oxidanylidene-butanoyl]oxyethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4,5-dimethyl-2-[2-[4-(4-methylsulfanylphenyl)-4-oxidanylidene-butanoyl]oxyethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4,5-dimethyl-2-[[2-[4-(4-methylsulfanylphenyl)-4-oxo-butanoyl]oxyacetyl]amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[2-[4-[4-(methylthio)phenyl]-1,4-dioxobutoxy]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-[[2-[4-(4-methylsulfanylphenyl)-4-oxobutanoyl]oxyacetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-[4-keto-4-[4-(methylthio)phenyl]butanoyl]oxyacetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H25NO6S2 MolecularWeight: 463.567

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)COC(=O)CCC(=O)C2=CC=C(C=C2)SC

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)COC(=O)CCC(=O)C2=CC=C(C=C2)SC

InChI

InChI=1S/C22H25NO6S2/c1-5-28-22(27)20-13(2)14(3)31-21(20)23-18(25)12-29-19(26)11-10-17(24)15-6-8-16(30-4)9-7-15/h6-9H,5,10-12H2,1-4H3,(H,23,25)