N-[(2S)-3-methyl-3-oxidanyl-1-(oxidanylamino)-1-oxidanylidene-butan-2-yl]-4-[4-(2-phenylethynyl)phenyl]piperazine-1-carboxamide

Systemtic Name: N-[(2S)-3-methyl-3-oxidanyl-1-(oxidanylamino)-1-oxidanylidene-butan-2-yl]-4-[4-(2-phenylethynyl)phenyl]piperazine-1-carboxamide Openeye Name: N-[(1S)-2-hydroxy-1-(hydroxycarbamoyl)-2-methyl-propyl]-4-[4-(2-phenylethynyl)phenyl]piperazine-1-carboxamide CAS Name: N-[(2S)-3-hydroxy-1-(hydroxyamino)-3-methyl-1-oxobutan-2-yl]-4-[4-(2-phenylethynyl)phenyl]-1-piperazinecarboxamide IUPAC Name: N-[(2S)-3-hydroxy-1-(hydroxyamino)-3-methyl-1-oxobutan-2-yl]-4-[4-(2-phenylethynyl)phenyl]piperazine-1-carboxamide Traditional Name: N-[(1S)-2-hydroxy-1-(hydroxycarbamoyl)-2-methyl-propyl]-4-[4-(2-phenylethynyl)phenyl]piperazine-1-carboxamide Formula: C24H28N4O4 MolecularWeight: 436.50352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C(=O)NO)NC(=O)N1CCN(CC1)C2=CC=C(C=C2)C#CC3=CC=CC=C3)O

Isomeric SMILES

CC(C)([C@@H](C(=O)NO)NC(=O)N1CCN(CC1)C2=CC=C(C=C2)C#CC3=CC=CC=C3)O

InChI

InChI=1S/C24H28N4O4/c1-24(2,31)21(22(29)26-32)25-23(30)28-16-14-27(15-17-28)20-12-10-19(11-13-20)9-8-18-6-4-3-5-7-18/h3-7,10-13,21,31-32H,14-17H2,1-2H3,(H,25,30)(H,26,29)/t21-/m1/s1