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

Systemtic Name: N-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(2-furylmethylamino)-2-oxo-ethyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-(2-furanylmethylamino)-2-oxoethyl]-1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(2-furfurylamino)-2-keto-ethyl]-1-mesitylsulfonyl-isonipecotamide Formula: C22H29N3O5S MolecularWeight: 447.54776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)NCC(=O)NCC3=CC=CO3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)NCC(=O)NCC3=CC=CO3)C

InChI

InChI=1S/C22H29N3O5S/c1-15-11-16(2)21(17(3)12-15)31(28,29)25-8-6-18(7-9-25)22(27)24-14-20(26)23-13-19-5-4-10-30-19/h4-5,10-12,18H,6-9,13-14H2,1-3H3,(H,23,26)(H,24,27)