ethyl 2-[2-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]propanoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]propanoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[2-[4-(4-fluorobenzoyl)piperazin-1-yl]propanoylamino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[2-[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]-1-oxopropyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-[4-(4-fluorobenzoyl)piperazin-1-yl]propanoylamino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[2-[4-(4-fluorobenzoyl)piperazino]propanoylamino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C23H28FN3O4S MolecularWeight: 461.549523

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C(C)N2CCN(CC2)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C(C)N2CCN(CC2)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H28FN3O4S/c1-5-31-23(30)19-14(2)16(4)32-21(19)25-20(28)15(3)26-10-12-27(13-11-26)22(29)17-6-8-18(24)9-7-17/h6-9,15H,5,10-13H2,1-4H3,(H,25,28)