N-(furan-2-ylmethyl)-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(furan-2-ylmethyl)-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(2-furylmethyl)-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(2-furanylmethyl)-1-(2,3,5,6-tetramethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(furan-2-ylmethyl)-1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(2-furfuryl)-1-(2,3,5,6-tetramethylphenyl)sulfonyl-isonipecotamide Formula: C21H28N2O4S MolecularWeight: 404.52302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=CO3)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=CO3)C)C

InChI

InChI=1S/C21H28N2O4S/c1-14-12-15(2)17(4)20(16(14)3)28(25,26)23-9-7-18(8-10-23)21(24)22-13-19-6-5-11-27-19/h5-6,11-12,18H,7-10,13H2,1-4H3,(H,22,24)