O4-ethyl O2-propan-2-yl 3-methyl-5-[2-(4-methylphenyl)sulfanylethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-propan-2-yl 3-methyl-5-[2-(4-methylphenyl)sulfanylethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: O4-ethyl O2-isopropyl 3-methyl-5-[[2-(p-tolylsulfanyl)acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[2-[(4-methylphenyl)thio]-1-oxoethyl]amino]thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-propan-2-yl ester IUPAC Name: 4-O-ethyl 2-O-propan-2-yl 3-methyl-5-[[2-(4-methylphenyl)sulfanylacetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-(p-tolylthio)acetyl]amino]thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-isopropyl ester Formula: C21H25NO5S2 MolecularWeight: 435.5569

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OC(C)C)NC(=O)CSC2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OC(C)C)NC(=O)CSC2=CC=C(C=C2)C

InChI

InChI=1S/C21H25NO5S2/c1-6-26-20(24)17-14(5)18(21(25)27-12(2)3)29-19(17)22-16(23)11-28-15-9-7-13(4)8-10-15/h7-10,12H,6,11H2,1-5H3,(H,22,23)