propan-2-yl 5-[2-(3-chloranylphenoxy)propanoylamino]-4-cyano-3-methyl-thiophene-2-carboxylate

Systemtic Name: propan-2-yl 5-[2-(3-chloranylphenoxy)propanoylamino]-4-cyano-3-methyl-thiophene-2-carboxylate Openeye Name: isopropyl 5-[2-(3-chlorophenoxy)propanoylamino]-4-cyano-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[2-(3-chlorophenoxy)-1-oxopropyl]amino]-4-cyano-3-methyl-2-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 5-[2-(3-chlorophenoxy)propanoylamino]-4-cyano-3-methylthiophene-2-carboxylate Traditional Name: 5-[2-(3-chlorophenoxy)propanoylamino]-4-cyano-3-methyl-thiophene-2-carboxylic acid isopropyl ester Formula: C19H19ClN2O4S MolecularWeight: 406.88316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C(C)OC2=CC(=CC=C2)Cl)C(=O)OC(C)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C(C)OC2=CC(=CC=C2)Cl)C(=O)OC(C)C

InChI

InChI=1S/C19H19ClN2O4S/c1-10(2)25-19(24)16-11(3)15(9-21)18(27-16)22-17(23)12(4)26-14-7-5-6-13(20)8-14/h5-8,10,12H,1-4H3,(H,22,23)