ethyl 2-[2-[(E)-3-(4-cyanophenyl)prop-2-enoyl]oxyethanoylamino]-5-ethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[(E)-3-(4-cyanophenyl)prop-2-enoyl]oxyethanoylamino]-5-ethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[(E)-3-(4-cyanophenyl)prop-2-enoyl]oxyacetyl]amino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[2-[(E)-3-(4-cyanophenyl)-1-oxoprop-2-enoxy]-1-oxoethyl]amino]-5-ethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(E)-3-(4-cyanophenyl)prop-2-enoyl]oxyacetyl]amino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[[2-[(E)-3-(4-cyanophenyl)acryloyl]oxyacetyl]amino]-5-ethyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H20N2O5S MolecularWeight: 412.4589

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)COC(=O)C=CC2=CC=C(C=C2)C#N)C(=O)OCC

Isomeric SMILES

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

InChI

InChI=1S/C21H20N2O5S/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/h5-11H,3-4,13H2,1-2H3,(H,23,24)/b10-9+