ethyl 2-[2-(4-tert-butylphenoxy)propanoylamino]-4-(4-ethylphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(4-tert-butylphenoxy)propanoylamino]-4-(4-ethylphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[2-(4-tert-butylphenoxy)propanoylamino]-4-(4-ethylphenyl)thiophene-3-carboxylate CAS Name: 2-[[2-(4-tert-butylphenoxy)-1-oxopropyl]amino]-4-(4-ethylphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(4-tert-butylphenoxy)propanoylamino]-4-(4-ethylphenyl)thiophene-3-carboxylate Traditional Name: 2-[2-(4-tert-butylphenoxy)propanoylamino]-4-(4-ethylphenyl)thiophene-3-carboxylic acid ethyl ester Formula: C28H33NO4S MolecularWeight: 479.63092

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCC)NC(=O)C(C)OC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCC)NC(=O)C(C)OC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C28H33NO4S/c1-7-19-9-11-20(12-10-19)23-17-34-26(24(23)27(31)32-8-2)29-25(30)18(3)33-22-15-13-21(14-16-22)28(4,5)6/h9-18H,7-8H2,1-6H3,(H,29,30)