ethyl 4-(2,4-dimethylphenyl)-2-(pentanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4-(2,4-dimethylphenyl)-2-(pentanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-(2,4-dimethylphenyl)-2-(pentanoylamino)thiophene-3-carboxylate CAS Name: 4-(2,4-dimethylphenyl)-2-(1-oxopentylamino)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2,4-dimethylphenyl)-2-(pentanoylamino)thiophene-3-carboxylate Traditional Name: 4-(2,4-dimethylphenyl)-2-(valerylamino)thiophene-3-carboxylic acid ethyl ester Formula: C20H25NO3S MolecularWeight: 359.4824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C(=CS1)C2=C(C=C(C=C2)C)C)C(=O)OCC

Isomeric SMILES

CCCCC(=O)NC1=C(C(=CS1)C2=C(C=C(C=C2)C)C)C(=O)OCC

InChI

InChI=1S/C20H25NO3S/c1-5-7-8-17(22)21-19-18(20(23)24-6-2)16(12-25-19)15-10-9-13(3)11-14(15)4/h9-12H,5-8H2,1-4H3,(H,21,22)