N-[(2S)-1-[(4-fluorophenyl)methylamino]-1-oxidanylidene-propan-2-yl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(2S)-1-[(4-fluorophenyl)methylamino]-1-oxidanylidene-propan-2-yl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(1S)-2-[(4-fluorophenyl)methylamino]-1-methyl-2-oxo-ethyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[(2S)-1-[(4-fluorophenyl)methylamino]-1-oxopropan-2-yl]-1-(4-methoxyphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(2S)-1-[(4-fluorophenyl)methylamino]-1-oxopropan-2-yl]-1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[(1S)-2-[(4-fluorobenzyl)amino]-2-keto-1-methyl-ethyl]-1-(4-methoxyphenyl)sulfonyl-isonipecotamide Formula: C23H28FN3O5S MolecularWeight: 477.548923

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=C(C=C1)F)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C23H28FN3O5S/c1-16(22(28)25-15-17-3-5-19(24)6-4-17)26-23(29)18-11-13-27(14-12-18)33(30,31)21-9-7-20(32-2)8-10-21/h3-10,16,18H,11-15H2,1-2H3,(H,25,28)(H,26,29)/t16-/m0/s1