N-[(2S)-1-(furan-2-ylmethylamino)-3-methyl-1-oxidanylidene-butan-2-yl]-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[(2S)-1-(furan-2-ylmethylamino)-3-methyl-1-oxidanylidene-butan-2-yl]-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[(1S)-1-(2-furylmethylcarbamoyl)-2-methyl-propyl]piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[(2S)-1-(2-furanylmethylamino)-3-methyl-1-oxobutan-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[(2S)-1-(furan-2-ylmethylamino)-3-methyl-1-oxobutan-2-yl]piperidine-4-carboxamide Traditional Name: 1-besyl-N-[(1S)-1-(2-furfurylcarbamoyl)-2-methyl-propyl]isonipecotamide Formula: C22H29N3O5S MolecularWeight: 447.54776

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CC=CO1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](C(=O)NCC1=CC=CO1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H29N3O5S/c1-16(2)20(22(27)23-15-18-7-6-14-30-18)24-21(26)17-10-12-25(13-11-17)31(28,29)19-8-4-3-5-9-19/h3-9,14,16-17,20H,10-13,15H2,1-2H3,(H,23,27)(H,24,26)/t20-/m0/s1