N'-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]-3,5-dinitro-benzohydrazide

Systemtic Name: N'-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]-3,5-dinitro-benzohydrazide Openeye Name: 3,5-dinitro-N'-[5-(p-tolyl)-1,3,4-thiadiazol-2-yl]benzohydrazide CAS Name: N'-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]-3,5-dinitrobenzohydrazide IUPAC Name: N'-[5-(4-methylphenyl)-1,3,4-thiadiazol-2-yl]-3,5-dinitrobenzohydrazide Traditional Name: 3,5-dinitro-N'-[5-(p-tolyl)-1,3,4-thiadiazol-2-yl]benzohydrazide Formula: C16H12N6O5S MolecularWeight: 400.36868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(S2)NNC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(S2)NNC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H12N6O5S/c1-9-2-4-10(5-3-9)15-18-20-16(28-15)19-17-14(23)11-6-12(21(24)25)8-13(7-11)22(26)27/h2-8H,1H3,(H,17,23)(H,19,20)