ethyl 4-(4-fluorophenyl)-2-[2-(3-methylpiperidin-1-yl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-fluorophenyl)-2-[2-(3-methylpiperidin-1-yl)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-fluorophenyl)-2-[[2-(3-methyl-1-piperidyl)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-(4-fluorophenyl)-2-[[2-(3-methyl-1-piperidinyl)-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-fluorophenyl)-2-[[2-(3-methylpiperidin-1-yl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-(4-fluorophenyl)-2-[[2-(3-methylpiperidino)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C21H25FN2O3S MolecularWeight: 404.498203

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)F)NC(=O)CN3CCCC(C3)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)F)NC(=O)CN3CCCC(C3)C

InChI

InChI=1S/C21H25FN2O3S/c1-3-27-21(26)19-17(15-6-8-16(22)9-7-15)13-28-20(19)23-18(25)12-24-10-4-5-14(2)11-24/h6-9,13-14H,3-5,10-12H2,1-2H3,(H,23,25)