ethyl 2-[[3-acetamido-3-(4-methoxyphenyl)propanoyl]amino]-5-ethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[3-acetamido-3-(4-methoxyphenyl)propanoyl]amino]-5-ethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[3-acetamido-3-(4-methoxyphenyl)propanoyl]amino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[3-acetamido-3-(4-methoxyphenyl)-1-oxopropyl]amino]-5-ethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[3-acetamido-3-(4-methoxyphenyl)propanoyl]amino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[[3-acetamido-3-(4-methoxyphenyl)propanoyl]amino]-5-ethyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CC(C2=CC=C(C=C2)OC)NC(=O)C)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CC(C2=CC=C(C=C2)OC)NC(=O)C)C(=O)OCC

InChI

InChI=1S/C21H26N2O5S/c1-5-16-11-17(21(26)28-6-2)20(29-16)23-19(25)12-18(22-13(3)24)14-7-9-15(27-4)10-8-14/h7-11,18H,5-6,12H2,1-4H3,(H,22,24)(H,23,25)