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

Systemtic Name: [2-cyclohexyl-3-[4-(2-piperidin-1-ylethoxy)phenyl]carbonyl-1-benzothiophen-6-yl] methanesulfonate Openeye Name: [2-cyclohexyl-3-[4-[2-(1-piperidyl)ethoxy]benzoyl]benzothiophen-6-yl] methanesulfonate CAS Name: methanesulfonic acid [2-cyclohexyl-3-[oxo-[4-[2-(1-piperidinyl)ethoxy]phenyl]methyl]-1-benzothiophen-6-yl] ester IUPAC Name: [2-cyclohexyl-3-[4-(2-piperidin-1-ylethoxy)benzoyl]-1-benzothiophen-6-yl] methanesulfonate Traditional Name: methanesulfonic acid [2-cyclohexyl-3-[4-(2-piperidinoethoxy)benzoyl]benzothiophen-6-yl] ester Formula: C29H35NO5S2 MolecularWeight: 541.7219

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=CC2=C(C=C1)C(=C(S2)C3CCCCC3)C(=O)C4=CC=C(C=C4)OCCN5CCCCC5

Isomeric SMILES

CS(=O)(=O)OC1=CC2=C(C=C1)C(=C(S2)C3CCCCC3)C(=O)C4=CC=C(C=C4)OCCN5CCCCC5

InChI

InChI=1S/C29H35NO5S2/c1-37(32,33)35-24-14-15-25-26(20-24)36-29(22-8-4-2-5-9-22)27(25)28(31)21-10-12-23(13-11-21)34-19-18-30-16-6-3-7-17-30/h10-15,20,22H,2-9,16-19H2,1H3