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

Systemtic Name: methyl 5-ethyl-2-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 5-ethyl-2-[[2-[4-(4-fluorophenyl)piperazin-1-yl]acetyl]amino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[2-[4-(4-fluorophenyl)-1-piperazinyl]-1-oxoethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-ethyl-2-[[2-[4-(4-fluorophenyl)piperazin-1-yl]acetyl]amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[[2-[4-(4-fluorophenyl)piperazino]acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C20H24FN3O3S MolecularWeight: 405.486263

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CN2CCN(CC2)C3=CC=C(C=C3)F)C(=O)OC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CN2CCN(CC2)C3=CC=C(C=C3)F)C(=O)OC

InChI

InChI=1S/C20H24FN3O3S/c1-3-16-12-17(20(26)27-2)19(28-16)22-18(25)13-23-8-10-24(11-9-23)15-6-4-14(21)5-7-15/h4-7,12H,3,8-11,13H2,1-2H3,(H,22,25)