N-[(2S)-1-[(4-fluorophenyl)methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(2S)-1-[(4-fluorophenyl)methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(1S)-1-[(4-fluorophenyl)methylcarbamoyl]-2-methyl-propyl]-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-[(2S)-1-[(4-fluorophenyl)methylamino]-3-methyl-1-oxobutan-2-yl]-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(2S)-1-[(4-fluorophenyl)methylamino]-3-methyl-1-oxobutan-2-yl]-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[(1S)-1-[(4-fluorobenzyl)carbamoyl]-2-methyl-propyl]-1-tosyl-isonipecotamide Formula: C25H32FN3O4S MolecularWeight: 489.602683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C(C)C)C(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N[C@@H](C(C)C)C(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C25H32FN3O4S/c1-17(2)23(25(31)27-16-19-6-8-21(26)9-7-19)28-24(30)20-12-14-29(15-13-20)34(32,33)22-10-4-18(3)5-11-22/h4-11,17,20,23H,12-16H2,1-3H3,(H,27,31)(H,28,30)/t23-/m0/s1