ethyl 2-[2-(4-cyano-2-ethoxy-phenoxy)ethanoylamino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(4-cyano-2-ethoxy-phenoxy)ethanoylamino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(4-cyano-2-ethoxy-phenoxy)acetyl]amino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate CAS Name: 2-[[2-(4-cyano-2-ethoxyphenoxy)-1-oxoethyl]amino]-4-methyl-5-(methylcarbamoyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(4-cyano-2-ethoxyphenoxy)acetyl]amino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylate Traditional Name: 2-[[2-(4-cyano-2-ethoxy-phenoxy)acetyl]amino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylic acid ethyl ester Formula: C21H23N3O6S MolecularWeight: 445.48882

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C#N)OCC(=O)NC2=C(C(=C(S2)C(=O)NC)C)C(=O)OCC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C#N)OCC(=O)NC2=C(C(=C(S2)C(=O)NC)C)C(=O)OCC

InChI

InChI=1S/C21H23N3O6S/c1-5-28-15-9-13(10-22)7-8-14(15)30-11-16(25)24-20-17(21(27)29-6-2)12(3)18(31-20)19(26)23-4/h7-9H,5-6,11H2,1-4H3,(H,23,26)(H,24,25)