N-(3-oxidanylpyridin-2-yl)-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-oxidanylpyridin-2-yl)-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-hydroxy-2-pyridyl)-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(3-hydroxy-2-pyridinyl)-1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(3-hydroxypyridin-2-yl)-1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(3-hydroxy-2-pyridyl)-1-mesitylsulfonyl-isonipecotamide Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(C=CC=N3)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(C=CC=N3)O)C

InChI

InChI=1S/C20H25N3O4S/c1-13-11-14(2)18(15(3)12-13)28(26,27)23-9-6-16(7-10-23)20(25)22-19-17(24)5-4-8-21-19/h4-5,8,11-12,16,24H,6-7,9-10H2,1-3H3,(H,21,22,25)