N-[(2R)-1-[(2Z)-2-hexan-2-ylidenehydrazinyl]-1-oxidanylidene-3-(phenylmethylsulfanyl)propan-2-yl]-4-nitro-benzamide

Systemtic Name: N-[(2R)-1-[(2Z)-2-hexan-2-ylidenehydrazinyl]-1-oxidanylidene-3-(phenylmethylsulfanyl)propan-2-yl]-4-nitro-benzamide Openeye Name: N-[(1R)-1-(benzylsulfanylmethyl)-2-[(2Z)-2-(1-methylpentylidene)hydrazino]-2-oxo-ethyl]-4-nitro-benzamide CAS Name: N-[(2R)-1-[(2Z)-2-hexan-2-ylidenehydrazinyl]-1-oxo-3-(phenylmethylthio)propan-2-yl]-4-nitrobenzamide IUPAC Name: N-[(2R)-3-benzylsulfanyl-1-[(2Z)-2-hexan-2-ylidenehydrazinyl]-1-oxopropan-2-yl]-4-nitrobenzamide Traditional Name: N-[(1R)-1-[(benzylthio)methyl]-2-keto-2-[(N'Z)-N'-(1-methylpentylidene)hydrazino]ethyl]-4-nitro-benzamide Formula: C23H28N4O4S MolecularWeight: 456.55782

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=NNC(=O)C(CSCC1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCCC/C(=N\NC(=O)[C@H](CSCC1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])/C

InChI

InChI=1S/C23H28N4O4S/c1-3-4-8-17(2)25-26-23(29)21(16-32-15-18-9-6-5-7-10-18)24-22(28)19-11-13-20(14-12-19)27(30)31/h5-7,9-14,21H,3-4,8,15-16H2,1-2H3,(H,24,28)(H,26,29)/b25-17-/t21-/m0/s1