ethyl 2-[2-(2-ethylbutanoyloxy)ethanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(2-ethylbutanoyloxy)ethanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(2-ethylbutanoyloxy)acetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-(2-ethyl-1-oxobutoxy)-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(2-ethylbutanoyloxy)acetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-(2-ethylbutanoyloxy)acetyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)OCC(=O)NC1=C(C(=CS1)C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCC(CC)C(=O)OCC(=O)NC1=C(C(=CS1)C2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C21H25NO5S/c1-4-14(5-2)20(24)27-12-17(23)22-19-18(21(25)26-6-3)16(13-28-19)15-10-8-7-9-11-15/h7-11,13-14H,4-6,12H2,1-3H3,(H,22,23)