1-(4-fluorophenyl)sulfonyl-N-[3-methyl-1-oxidanylidene-1-(pyridin-3-ylmethylamino)butan-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-(4-fluorophenyl)sulfonyl-N-[3-methyl-1-oxidanylidene-1-(pyridin-3-ylmethylamino)butan-2-yl]piperidine-4-carboxamide Openeye Name: 1-(4-fluorophenyl)sulfonyl-N-[2-methyl-1-(3-pyridylmethylcarbamoyl)propyl]piperidine-4-carboxamide CAS Name: 1-(4-fluorophenyl)sulfonyl-N-[3-methyl-1-oxo-1-(3-pyridinylmethylamino)butan-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-(4-fluorophenyl)sulfonyl-N-[3-methyl-1-oxo-1-(pyridin-3-ylmethylamino)butan-2-yl]piperidine-4-carboxamide Traditional Name: 1-(4-fluorophenyl)sulfonyl-N-[2-methyl-1-(3-pyridylmethylcarbamoyl)propyl]isonipecotamide Formula: C23H29FN4O4S MolecularWeight: 476.564163

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CN=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)C(C(=O)NCC1=CN=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H29FN4O4S/c1-16(2)21(23(30)26-15-17-4-3-11-25-14-17)27-22(29)18-9-12-28(13-10-18)33(31,32)20-7-5-19(24)6-8-20/h3-8,11,14,16,18,21H,9-10,12-13,15H2,1-2H3,(H,26,30)(H,27,29)