ethyl 4-cyano-5-(4-cyclohexylphenyl)-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 4-cyano-5-(4-cyclohexylphenyl)-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-5-(4-cyclohexylphenyl)-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-(4-cyclohexylphenyl)-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-5-(4-cyclohexylphenyl)-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-(4-cyclohexylphenyl)-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C21H23NO2S MolecularWeight: 353.47782

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)C2=CC=C(C=C2)C3CCCCC3)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)C2=CC=C(C=C2)C3CCCCC3)C#N)C

InChI

InChI=1S/C21H23NO2S/c1-3-24-21(23)19-14(2)18(13-22)20(25-19)17-11-9-16(10-12-17)15-7-5-4-6-8-15/h9-12,15H,3-8H2,1-2H3