ethyl 5-[[1-(4-chlorophenyl)cyclopentyl]carbonylamino]-4-cyano-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-[[1-(4-chlorophenyl)cyclopentyl]carbonylamino]-4-cyano-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[[1-(4-chlorophenyl)cyclopentanecarbonyl]amino]-4-cyano-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[[1-(4-chlorophenyl)cyclopentyl]-oxomethyl]amino]-4-cyano-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[1-(4-chlorophenyl)cyclopentanecarbonyl]amino]-4-cyano-3-methylthiophene-2-carboxylate Traditional Name: 5-[[1-(4-chlorophenyl)cyclopentanecarbonyl]amino]-4-cyano-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C21H21ClN2O3S MolecularWeight: 416.92104

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2(CCCC2)C3=CC=C(C=C3)Cl)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2(CCCC2)C3=CC=C(C=C3)Cl)C#N)C

InChI

InChI=1S/C21H21ClN2O3S/c1-3-27-19(25)17-13(2)16(12-23)18(28-17)24-20(26)21(10-4-5-11-21)14-6-8-15(22)9-7-14/h6-9H,3-5,10-11H2,1-2H3,(H,24,26)