N-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(2-furylmethylamino)-2-oxo-ethyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-(2-furanylmethylamino)-2-oxoethyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(2-furfurylamino)-2-keto-ethyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-isonipecotamide Formula: C23H31N3O5S MolecularWeight: 461.57434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N3O5S/c1-15-12-16(2)18(4)22(17(15)3)32(29,30)26-9-7-19(8-10-26)23(28)25-14-21(27)24-13-20-6-5-11-31-20/h5-6,11-12,19H,7-10,13-14H2,1-4H3,(H,24,27)(H,25,28)