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

Systemtic Name: N-[(2S)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(1S)-2-(cyclopropylamino)-1-methyl-2-oxo-ethyl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[(2S)-1-(cyclopropylamino)-1-oxopropan-2-yl]-1-(4-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(2S)-1-(cyclopropylamino)-1-oxopropan-2-yl]-1-(4-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[(1S)-2-(cyclopropylamino)-2-keto-1-methyl-ethyl]-1-(4-fluorophenyl)sulfonyl-isonipecotamide Formula: C18H24FN3O4S MolecularWeight: 397.464263

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C[C@@H](C(=O)NC1CC1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H24FN3O4S/c1-12(17(23)21-15-4-5-15)20-18(24)13-8-10-22(11-9-13)27(25,26)16-6-2-14(19)3-7-16/h2-3,6-7,12-13,15H,4-5,8-11H2,1H3,(H,20,24)(H,21,23)/t12-/m0/s1