4-nitro-N-[1-oxidanylidene-3-(phenylmethylsulfanyl)-1-[(2E)-2-(thiophen-2-ylmethylidene)hydrazinyl]propan-2-yl]benzamide

Systemtic Name: 4-nitro-N-[1-oxidanylidene-3-(phenylmethylsulfanyl)-1-[(2E)-2-(thiophen-2-ylmethylidene)hydrazinyl]propan-2-yl]benzamide Openeye Name: N-[1-(benzylsulfanylmethyl)-2-oxo-2-[(2E)-2-(2-thienylmethylene)hydrazino]ethyl]-4-nitro-benzamide CAS Name: 4-nitro-N-[1-oxo-3-(phenylmethylthio)-1-[(2E)-2-(thiophen-2-ylmethylidene)hydrazinyl]propan-2-yl]benzamide IUPAC Name: N-[3-benzylsulfanyl-1-oxo-1-[(2E)-2-(thiophen-2-ylmethylidene)hydrazinyl]propan-2-yl]-4-nitrobenzamide Traditional Name: N-[1-[(benzylthio)methyl]-2-keto-2-[(N'E)-N'-(2-thenylidene)hydrazino]ethyl]-4-nitro-benzamide Formula: C22H20N4O4S2 MolecularWeight: 468.5486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC(C(=O)NN=CC2=CC=CS2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CSCC(C(=O)N/N=C/C2=CC=CS2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H20N4O4S2/c27-21(17-8-10-18(11-9-17)26(29)30)24-20(15-31-14-16-5-2-1-3-6-16)22(28)25-23-13-19-7-4-12-32-19/h1-13,20H,14-15H2,(H,24,27)(H,25,28)/b23-13+