1-ethyl-N-(oxan-2-yloxy)-4-(4-phenylsulfanylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: 1-ethyl-N-(oxan-2-yloxy)-4-(4-phenylsulfanylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-ethyl-4-(4-phenylsulfanylphenyl)sulfonyl-N-tetrahydropyran-2-yloxy-piperidine-4-carboxamide CAS Name: 1-ethyl-N-(2-oxanyloxy)-4-[4-(phenylthio)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: 1-ethyl-N-(oxan-2-yloxy)-4-(4-phenylsulfanylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: 1-ethyl-4-[4-(phenylthio)phenyl]sulfonyl-N-tetrahydropyran-2-yloxy-isonipecotamide Formula: C25H32N2O5S2 MolecularWeight: 504.66198

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(CC1)(C(=O)NOC2CCCCO2)S(=O)(=O)C3=CC=C(C=C3)SC4=CC=CC=C4

Isomeric SMILES

CCN1CCC(CC1)(C(=O)NOC2CCCCO2)S(=O)(=O)C3=CC=C(C=C3)SC4=CC=CC=C4

InChI

InChI=1S/C25H32N2O5S2/c1-2-27-17-15-25(16-18-27,24(28)26-32-23-10-6-7-19-31-23)34(29,30)22-13-11-21(12-14-22)33-20-8-4-3-5-9-20/h3-5,8-9,11-14,23H,2,6-7,10,15-19H2,1H3,(H,26,28)