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

Systemtic Name: ethyl 4-cyano-5-(2-cyclohexylethanoylamino)-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-5-[(2-cyclohexylacetyl)amino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[(2-cyclohexyl-1-oxoethyl)amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-5-[(2-cyclohexylacetyl)amino]-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-[(2-cyclohexylacetyl)amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C17H22N2O3S MolecularWeight: 334.43318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)CC2CCCCC2)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)CC2CCCCC2)C#N)C

InChI

InChI=1S/C17H22N2O3S/c1-3-22-17(21)15-11(2)13(10-18)16(23-15)19-14(20)9-12-7-5-4-6-8-12/h12H,3-9H2,1-2H3,(H,19,20)