(2S)-2-(tert-butylcarbamothioylamino)-N'-oxidanyl-N-phenyl-octanediamide

Systemtic Name: (2S)-2-(tert-butylcarbamothioylamino)-N'-oxidanyl-N-phenyl-octanediamide Openeye Name: (2S)-2-(tert-butylcarbamothioylamino)-8-(hydroxyamino)-8-oxo-N-phenyl-octanamide CAS Name: (2S)-2-[[(tert-butylamino)-sulfanylidenemethyl]amino]-N'-hydroxy-N-phenyloctanediamide IUPAC Name: (2S)-2-(tert-butylcarbamothioylamino)-N'-hydroxy-N-phenyloctanediamide Traditional Name: (2S)-2-(tert-butylthiocarbamoylamino)-8-(hydroxyamino)-8-keto-N-phenyl-caprylamide Formula: C19H30N4O3S MolecularWeight: 394.5315

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NC(CCCCCC(=O)NO)C(=O)NC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)NC(=S)N[C@@H](CCCCCC(=O)NO)C(=O)NC1=CC=CC=C1

InChI

InChI=1S/C19H30N4O3S/c1-19(2,3)22-18(27)21-15(12-8-5-9-13-16(24)23-26)17(25)20-14-10-6-4-7-11-14/h4,6-7,10-11,15,26H,5,8-9,12-13H2,1-3H3,(H,20,25)(H,23,24)(H2,21,22,27)/t15-/m0/s1