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

Systemtic Name: [2-(4-fluorophenyl)-3-[4-(2-piperidin-1-ylethoxy)phenyl]carbonyl-1-benzothiophen-6-yl] sulfamate Openeye Name: [2-(4-fluorophenyl)-3-[4-[2-(1-piperidyl)ethoxy]benzoyl]benzothiophen-6-yl] sulfamate CAS Name: sulfamic 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] sulfamate Traditional Name: sulfamic acid [2-(4-fluorophenyl)-3-[4-(2-piperidinoethoxy)benzoyl]benzothiophen-6-yl] ester Formula: C28H27FN2O5S2 MolecularWeight: 554.652783

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCOC2=CC=C(C=C2)C(=O)C3=C(SC4=C3C=CC(=C4)OS(=O)(=O)N)C5=CC=C(C=C5)F

Isomeric SMILES

C1CCN(CC1)CCOC2=CC=C(C=C2)C(=O)C3=C(SC4=C3C=CC(=C4)OS(=O)(=O)N)C5=CC=C(C=C5)F

InChI

InChI=1S/C28H27FN2O5S2/c29-21-8-4-20(5-9-21)28-26(24-13-12-23(18-25(24)37-28)36-38(30,33)34)27(32)19-6-10-22(11-7-19)35-17-16-31-14-2-1-3-15-31/h4-13,18H,1-3,14-17H2,(H2,30,33,34)