1-(4-methylphenyl)sulfonyl-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)piperidine-4-carboxamide

Systemtic Name: 1-(4-methylphenyl)sulfonyl-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)piperidine-4-carboxamide Openeye Name: N-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-phenyl)-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: 1-(4-methylphenyl)sulfonyl-N-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-methylphenyl)sulfonyl-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)piperidine-4-carboxamide Traditional Name: N-(5-morpholinosulfonyl-2-pyrrolidino-phenyl)-1-tosyl-isonipecotamide Formula: C27H36N4O6S2 MolecularWeight: 576.72794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)N5CCCC5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)N5CCCC5

InChI

InChI=1S/C27H36N4O6S2/c1-21-4-6-23(7-5-21)38(33,34)30-14-10-22(11-15-30)27(32)28-25-20-24(8-9-26(25)29-12-2-3-13-29)39(35,36)31-16-18-37-19-17-31/h4-9,20,22H,2-3,10-19H2,1H3,(H,28,32)