ethyl 4-fluoranyl-3-[[4-(phenylcarbamoyl)piperidin-1-yl]methyl]-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 4-fluoranyl-3-[[4-(phenylcarbamoyl)piperidin-1-yl]methyl]-1-benzothiophene-2-carboxylate Openeye Name: ethyl 4-fluoro-3-[[4-(phenylcarbamoyl)-1-piperidyl]methyl]benzothiophene-2-carboxylate CAS Name: 3-[[4-[anilino(oxo)methyl]-1-piperidinyl]methyl]-4-fluoro-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-fluoro-3-[[4-(phenylcarbamoyl)piperidin-1-yl]methyl]-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-[[4-(phenylcarbamoyl)piperidino]methyl]benzothiophene-2-carboxylic acid ethyl ester Formula: C24H25FN2O3S MolecularWeight: 440.530303

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)CN3CCC(CC3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)CN3CCC(CC3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C24H25FN2O3S/c1-2-30-24(29)22-18(21-19(25)9-6-10-20(21)31-22)15-27-13-11-16(12-14-27)23(28)26-17-7-4-3-5-8-17/h3-10,16H,2,11-15H2,1H3,(H,26,28)