1-[(2-fluorophenyl)methylsulfonyl]-N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)piperidine-4-carboxamide

Systemtic Name: 1-[(2-fluorophenyl)methylsulfonyl]-N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)piperidine-4-carboxamide Openeye Name: 1-[(2-fluorophenyl)methylsulfonyl]-N-[2-methoxy-5-(1-piperidylsulfonyl)phenyl]piperidine-4-carboxamide CAS Name: 1-[(2-fluorophenyl)methylsulfonyl]-N-[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-[(2-fluorophenyl)methylsulfonyl]-N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)piperidine-4-carboxamide Traditional Name: 1-(2-fluorobenzyl)sulfonyl-N-(2-methoxy-5-piperidinosulfonyl-phenyl)isonipecotamide Formula: C25H32FN3O6S2 MolecularWeight: 553.666483

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4F

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4F

InChI

InChI=1S/C25H32FN3O6S2/c1-35-24-10-9-21(37(33,34)29-13-5-2-6-14-29)17-23(24)27-25(30)19-11-15-28(16-12-19)36(31,32)18-20-7-3-4-8-22(20)26/h3-4,7-10,17,19H,2,5-6,11-16,18H2,1H3,(H,27,30)