ethyl 2-[2-[3-(4-cyanophenyl)propanoyloxy]ethanoylamino]-5-ethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[3-(4-cyanophenyl)propanoyloxy]ethanoylamino]-5-ethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[3-(4-cyanophenyl)propanoyloxy]acetyl]amino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[2-[3-(4-cyanophenyl)-1-oxopropoxy]-1-oxoethyl]amino]-5-ethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[3-(4-cyanophenyl)propanoyloxy]acetyl]amino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[[2-[3-(4-cyanophenyl)propanoyloxy]acetyl]amino]-5-ethyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)COC(=O)CCC2=CC=C(C=C2)C#N)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)COC(=O)CCC2=CC=C(C=C2)C#N)C(=O)OCC

InChI

InChI=1S/C21H22N2O5S/c1-3-16-11-17(21(26)27-4-2)20(29-16)23-18(24)13-28-19(25)10-9-14-5-7-15(12-22)8-6-14/h5-8,11H,3-4,9-10,13H2,1-2H3,(H,23,24)