ethyl 5-ethanoyl-2-[2-[4-(2-fluorophenyl)piperazin-1-yl]ethanoylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethanoyl-2-[2-[4-(2-fluorophenyl)piperazin-1-yl]ethanoylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-2-[[2-[4-(2-fluorophenyl)piperazin-1-yl]acetyl]amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-2-[[2-[4-(2-fluorophenyl)-1-piperazinyl]-1-oxoethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-2-[[2-[4-(2-fluorophenyl)piperazin-1-yl]acetyl]amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-acetyl-2-[[2-[4-(2-fluorophenyl)piperazino]acetyl]amino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H26FN3O4S MolecularWeight: 447.522943

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)CN2CCN(CC2)C3=CC=CC=C3F

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)CN2CCN(CC2)C3=CC=CC=C3F

InChI

InChI=1S/C22H26FN3O4S/c1-4-30-22(29)19-14(2)20(15(3)27)31-21(19)24-18(28)13-25-9-11-26(12-10-25)17-8-6-5-7-16(17)23/h5-8H,4,9-13H2,1-3H3,(H,24,28)