4-nitro-N'-[2-[1-(4-propan-2-ylphenyl)imidazol-2-yl]sulfanylethanoyl]benzohydrazide

Systemtic Name: 4-nitro-N'-[2-[1-(4-propan-2-ylphenyl)imidazol-2-yl]sulfanylethanoyl]benzohydrazide Openeye Name: N'-[2-[1-(4-isopropylphenyl)imidazol-2-yl]sulfanylacetyl]-4-nitro-benzohydrazide CAS Name: 4-nitro-N'-[1-oxo-2-[[1-(4-propan-2-ylphenyl)-2-imidazolyl]thio]ethyl]benzohydrazide IUPAC Name: 4-nitro-N'-[2-[1-(4-propan-2-ylphenyl)imidazol-2-yl]sulfanylacetyl]benzohydrazide Traditional Name: 4-nitro-N'-[2-[(1-p-cumenylimidazol-2-yl)thio]acetyl]benzohydrazide Formula: C21H21N5O4S MolecularWeight: 439.48754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C=CN=C2SCC(=O)NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C=CN=C2SCC(=O)NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H21N5O4S/c1-14(2)15-3-7-17(8-4-15)25-12-11-22-21(25)31-13-19(27)23-24-20(28)16-5-9-18(10-6-16)26(29)30/h3-12,14H,13H2,1-2H3,(H,23,27)(H,24,28)