4-nitro-N-[(2S)-1-oxidanylidene-1-[2-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-3-(phenylmethylsulfanyl)propan-2-yl]benzamide

Systemtic Name: 4-nitro-N-[(2S)-1-oxidanylidene-1-[2-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-3-(phenylmethylsulfanyl)propan-2-yl]benzamide Openeye Name: N-[(1S)-1-(benzylsulfanylmethyl)-2-oxo-2-[2-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]hydrazino]ethyl]-4-nitro-benzamide CAS Name: 4-nitro-N-[(2S)-1-oxo-1-[(4-oxo-1-cyclohexa-2,5-dienylidene)methylhydrazo]-3-(phenylmethylthio)propan-2-yl]benzamide IUPAC Name: N-[(2S)-3-benzylsulfanyl-1-oxo-1-[2-[(4-oxocyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]propan-2-yl]-4-nitrobenzamide Traditional Name: N-[(1S)-1-[(benzylthio)methyl]-2-keto-2-[N'-[(4-ketocyclohexa-2,5-dien-1-ylidene)methyl]hydrazino]ethyl]-4-nitro-benzamide Formula: C24H22N4O5S MolecularWeight: 478.52028

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC(C(=O)NNC=C2C=CC(=O)C=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CSC[C@H](C(=O)NNC=C2C=CC(=O)C=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H22N4O5S/c29-21-12-6-17(7-13-21)14-25-27-24(31)22(16-34-15-18-4-2-1-3-5-18)26-23(30)19-8-10-20(11-9-19)28(32)33/h1-14,22,25H,15-16H2,(H,26,30)(H,27,31)/t22-/m1/s1