ethyl 5-[(4-butylcyclohexyl)carbonylamino]-4-cyano-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-[(4-butylcyclohexyl)carbonylamino]-4-cyano-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[(4-butylcyclohexanecarbonyl)amino]-4-cyano-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[(4-butylcyclohexyl)-oxomethyl]amino]-4-cyano-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-butylcyclohexanecarbonyl)amino]-4-cyano-3-methylthiophene-2-carboxylate Traditional Name: 5-[(4-butylcyclohexanecarbonyl)amino]-4-cyano-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C20H28N2O3S MolecularWeight: 376.51292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)NC2=C(C(=C(S2)C(=O)OCC)C)C#N

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)NC2=C(C(=C(S2)C(=O)OCC)C)C#N

InChI

InChI=1S/C20H28N2O3S/c1-4-6-7-14-8-10-15(11-9-14)18(23)22-19-16(12-21)13(3)17(26-19)20(24)25-5-2/h14-15H,4-11H2,1-3H3,(H,22,23)