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

Systemtic Name: 3-nitro-N'-[2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylethanoyl]benzohydrazide Openeye Name: N'-[2-[1-(2-isopropylphenyl)imidazol-2-yl]sulfanylacetyl]-3-nitro-benzohydrazide CAS Name: 3-nitro-N'-[1-oxo-2-[[1-(2-propan-2-ylphenyl)-2-imidazolyl]thio]ethyl]benzohydrazide IUPAC Name: 3-nitro-N'-[2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylacetyl]benzohydrazide Traditional Name: 3-nitro-N'-[2-[(1-o-cumenylimidazol-2-yl)thio]acetyl]benzohydrazide Formula: C21H21N5O4S MolecularWeight: 439.48754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1N2C=CN=C2SCC(=O)NNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=CC=C1N2C=CN=C2SCC(=O)NNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

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