ethyl 2-[3-(4-tert-butylphenyl)propanoylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[3-(4-tert-butylphenyl)propanoylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-2-[3-(4-tert-butylphenyl)propanoylamino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-2-[[3-(4-tert-butylphenyl)-1-oxopropyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-2-[3-(4-tert-butylphenyl)propanoylamino]-4-methylthiophene-3-carboxylate Traditional Name: 5-acetyl-2-[3-(4-tert-butylphenyl)propanoylamino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C23H29NO4S MolecularWeight: 415.54566

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)CCC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)CCC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C23H29NO4S/c1-7-28-22(27)19-14(2)20(15(3)25)29-21(19)24-18(26)13-10-16-8-11-17(12-9-16)23(4,5)6/h8-9,11-12H,7,10,13H2,1-6H3,(H,24,26)