O4-ethyl O2-methyl 3-methyl-5-[[3-(2-methylpropoxy)phenyl]carbonylamino]thiophene-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-methyl 3-methyl-5-[[3-(2-methylpropoxy)phenyl]carbonylamino]thiophene-2,4-dicarboxylate Openeye Name: O4-ethyl O2-methyl 5-[(3-isobutoxybenzoyl)amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[[3-(2-methylpropoxy)phenyl]-oxomethyl]amino]thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-methyl ester IUPAC Name: 4-O-ethyl 2-O-methyl 3-methyl-5-[[3-(2-methylpropoxy)benzoyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 5-[(3-isobutoxybenzoyl)amino]-3-methyl-thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-methyl ester Formula: C21H25NO6S MolecularWeight: 419.4913

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25NO6S/c1-6-27-20(24)16-13(4)17(21(25)26-5)29-19(16)22-18(23)14-8-7-9-15(10-14)28-11-12(2)3/h7-10,12H,6,11H2,1-5H3,(H,22,23)