(2S)-N'-oxidanyl-2-(3-phenylpropylcarbamoylamino)-N-(4-phenyl-1,3-thiazol-2-yl)octanediamide

Systemtic Name: (2S)-N'-oxidanyl-2-(3-phenylpropylcarbamoylamino)-N-(4-phenyl-1,3-thiazol-2-yl)octanediamide Openeye Name: (2S)-8-(hydroxyamino)-8-oxo-2-(3-phenylpropylcarbamoylamino)-N-(4-phenylthiazol-2-yl)octanamide CAS Name: (2S)-N'-hydroxy-2-[[oxo-(3-phenylpropylamino)methyl]amino]-N-(4-phenyl-2-thiazolyl)octanediamide IUPAC Name: (2S)-N'-hydroxy-2-(3-phenylpropylcarbamoylamino)-N-(4-phenyl-1,3-thiazol-2-yl)octanediamide Traditional Name: (2S)-8-(hydroxyamino)-8-keto-2-(3-phenylpropylcarbamoylamino)-N-(4-phenylthiazol-2-yl)caprylamide Formula: C27H33N5O4S MolecularWeight: 523.64702

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC(=O)NC(CCCCCC(=O)NO)C(=O)NC2=NC(=CS2)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCCNC(=O)N[C@@H](CCCCCC(=O)NO)C(=O)NC2=NC(=CS2)C3=CC=CC=C3

InChI

InChI=1S/C27H33N5O4S/c33-24(32-36)17-9-3-8-16-22(29-26(35)28-18-10-13-20-11-4-1-5-12-20)25(34)31-27-30-23(19-37-27)21-14-6-2-7-15-21/h1-2,4-7,11-12,14-15,19,22,36H,3,8-10,13,16-18H2,(H,32,33)(H2,28,29,35)(H,30,31,34)/t22-/m0/s1