(2S)-N'-oxidanyl-N-(phenylmethyl)-2-(thiophen-2-ylcarbonylamino)octanediamide

Systemtic Name: (2S)-N'-oxidanyl-N-(phenylmethyl)-2-(thiophen-2-ylcarbonylamino)octanediamide Openeye Name: N-[(1S)-1-(benzylcarbamoyl)-7-(hydroxyamino)-7-oxo-heptyl]thiophene-2-carboxamide CAS Name: (2S)-N'-hydroxy-2-[[oxo(thiophen-2-yl)methyl]amino]-N-(phenylmethyl)octanediamide IUPAC Name: (2S)-N-benzyl-N'-hydroxy-2-(thiophene-2-carbonylamino)octanediamide Traditional Name: N-[(1S)-1-(benzylcarbamoyl)-7-(hydroxyamino)-7-keto-heptyl]thiophene-2-carboxamide Formula: C20H25N3O4S MolecularWeight: 403.4952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C(CCCCCC(=O)NO)NC(=O)C2=CC=CS2

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)[C@H](CCCCCC(=O)NO)NC(=O)C2=CC=CS2

InChI

InChI=1S/C20H25N3O4S/c24-18(23-27)12-6-2-5-10-16(22-20(26)17-11-7-13-28-17)19(25)21-14-15-8-3-1-4-9-15/h1,3-4,7-9,11,13,16,27H,2,5-6,10,12,14H2,(H,21,25)(H,22,26)(H,23,24)/t16-/m0/s1