[2-(4-fluorophenyl)-3-[4-(2-piperidin-1-ylethoxy)phenyl]carbonyl-1-benzothiophen-6-yl] methanesulfonate

Systemtic Name: [2-(4-fluorophenyl)-3-[4-(2-piperidin-1-ylethoxy)phenyl]carbonyl-1-benzothiophen-6-yl] methanesulfonate Openeye Name: [2-(4-fluorophenyl)-3-[4-[2-(1-piperidyl)ethoxy]benzoyl]benzothiophen-6-yl] methanesulfonate CAS Name: methanesulfonic acid [2-(4-fluorophenyl)-3-[oxo-[4-[2-(1-piperidinyl)ethoxy]phenyl]methyl]-1-benzothiophen-6-yl] ester IUPAC Name: [2-(4-fluorophenyl)-3-[4-(2-piperidin-1-ylethoxy)benzoyl]-1-benzothiophen-6-yl] methanesulfonate Traditional Name: methanesulfonic acid [2-(4-fluorophenyl)-3-[4-(2-piperidinoethoxy)benzoyl]benzothiophen-6-yl] ester Formula: C29H28FNO5S2 MolecularWeight: 553.664723

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=CC2=C(C=C1)C(=C(S2)C3=CC=C(C=C3)F)C(=O)C4=CC=C(C=C4)OCCN5CCCCC5

Isomeric SMILES

CS(=O)(=O)OC1=CC2=C(C=C1)C(=C(S2)C3=CC=C(C=C3)F)C(=O)C4=CC=C(C=C4)OCCN5CCCCC5

InChI

InChI=1S/C29H28FNO5S2/c1-38(33,34)36-24-13-14-25-26(19-24)37-29(21-5-9-22(30)10-6-21)27(25)28(32)20-7-11-23(12-8-20)35-18-17-31-15-3-2-4-16-31/h5-14,19H,2-4,15-18H2,1H3