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

Systemtic Name: ethyl 2-[2-[(3-cyanophenyl)amino]ethanoylamino]-4-ethyl-5-methyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(3-cyanoanilino)acetyl]amino]-4-ethyl-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[2-(3-cyanoanilino)-1-oxoethyl]amino]-4-ethyl-5-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(3-cyanoanilino)acetyl]amino]-4-ethyl-5-methylthiophene-3-carboxylate Traditional Name: 2-[[2-(3-cyanoanilino)acetyl]amino]-4-ethyl-5-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H21N3O3S MolecularWeight: 371.45334

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OCC)NC(=O)CNC2=CC=CC(=C2)C#N)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OCC)NC(=O)CNC2=CC=CC(=C2)C#N)C

InChI

InChI=1S/C19H21N3O3S/c1-4-15-12(3)26-18(17(15)19(24)25-5-2)22-16(23)11-21-14-8-6-7-13(9-14)10-20/h6-9,21H,4-5,11H2,1-3H3,(H,22,23)