methyl 2-[2-(2,6-dimethylpiperidin-1-yl)ethanoylamino]-4-(4-fluorophenyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-(2,6-dimethylpiperidin-1-yl)ethanoylamino]-4-(4-fluorophenyl)thiophene-3-carboxylate Openeye Name: methyl 2-[[2-(2,6-dimethyl-1-piperidyl)acetyl]amino]-4-(4-fluorophenyl)thiophene-3-carboxylate CAS Name: 2-[[2-(2,6-dimethyl-1-piperidinyl)-1-oxoethyl]amino]-4-(4-fluorophenyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(2,6-dimethylpiperidin-1-yl)acetyl]amino]-4-(4-fluorophenyl)thiophene-3-carboxylate Traditional Name: 2-[[2-(2,6-dimethylpiperidino)acetyl]amino]-4-(4-fluorophenyl)thiophene-3-carboxylic acid methyl ester Formula: C21H25FN2O3S MolecularWeight: 404.498203

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1CC(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)F)C(=O)OC)C

Isomeric SMILES

CC1CCCC(N1CC(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)F)C(=O)OC)C

InChI

InChI=1S/C21H25FN2O3S/c1-13-5-4-6-14(2)24(13)11-18(25)23-20-19(21(26)27-3)17(12-28-20)15-7-9-16(22)10-8-15/h7-10,12-14H,4-6,11H2,1-3H3,(H,23,25)