ethyl 2-[2-[(3-cyanophenyl)amino]ethanoylamino]-5-propan-2-yl-thiophene-3-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C(C)C)NC(=O)CNC2=CC=CC(=C2)C#N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C(C)C)NC(=O)CNC2=CC=CC(=C2)C#N

InChI

InChI=1S/C19H21N3O3S/c1-4-25-19(24)15-9-16(12(2)3)26-18(15)22-17(23)11-21-14-7-5-6-13(8-14)10-20/h5-9,12,21H,4,11H2,1-3H3,(H,22,23)