N'-[2-[[1-(2,4-dimethylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoyl]-4-nitro-benzohydrazide

Systemtic Name: N'-[2-[[1-(2,4-dimethylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoyl]-4-nitro-benzohydrazide Openeye Name: N'-[2-[1-(2,4-dimethylphenyl)tetrazol-5-yl]sulfanylacetyl]-4-nitro-benzohydrazide CAS Name: N'-[2-[[1-(2,4-dimethylphenyl)-5-tetrazolyl]thio]-1-oxoethyl]-4-nitrobenzohydrazide IUPAC Name: N'-[2-[1-(2,4-dimethylphenyl)tetrazol-5-yl]sulfanylacetyl]-4-nitrobenzohydrazide Traditional Name: N'-[2-[[1-(2,4-dimethylphenyl)tetrazol-5-yl]thio]acetyl]-4-nitro-benzohydrazide Formula: C18H17N7O4S MolecularWeight: 427.43708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=NN=N2)SCC(=O)NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=NN=N2)SCC(=O)NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C18H17N7O4S/c1-11-3-8-15(12(2)9-11)24-18(21-22-23-24)30-10-16(26)19-20-17(27)13-4-6-14(7-5-13)25(28)29/h3-9H,10H2,1-2H3,(H,19,26)(H,20,27)