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

Systemtic Name: ethyl 2-[2-[4-(4-cyanophenyl)phenoxy]ethanoylamino]-5-ethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[4-(4-cyanophenyl)phenoxy]acetyl]amino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[2-[4-(4-cyanophenyl)phenoxy]-1-oxoethyl]amino]-5-ethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[4-(4-cyanophenyl)phenoxy]acetyl]amino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[[2-[4-(4-cyanophenyl)phenoxy]acetyl]amino]-5-ethyl-thiophene-3-carboxylic acid ethyl ester Formula: C24H22N2O4S MolecularWeight: 434.50748

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)COC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)COC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)C(=O)OCC

InChI

InChI=1S/C24H22N2O4S/c1-3-20-13-21(24(28)29-4-2)23(31-20)26-22(27)15-30-19-11-9-18(10-12-19)17-7-5-16(14-25)6-8-17/h5-13H,3-4,15H2,1-2H3,(H,26,27)