3,4,5-trimethoxy-N'-[4-(3-methylbutylsulfanyl)-3-nitro-phenyl]carbonyl-benzohydrazide

Systemtic Name: 3,4,5-trimethoxy-N'-[4-(3-methylbutylsulfanyl)-3-nitro-phenyl]carbonyl-benzohydrazide Openeye Name: N'-(4-isopentylsulfanyl-3-nitro-benzoyl)-3,4,5-trimethoxy-benzohydrazide CAS Name: 3,4,5-trimethoxy-N'-[[4-(3-methylbutylthio)-3-nitrophenyl]-oxomethyl]benzohydrazide IUPAC Name: 3,4,5-trimethoxy-N'-[4-(3-methylbutylsulfanyl)-3-nitrobenzoyl]benzohydrazide Traditional Name: N'-[4-(isoamylthio)-3-nitro-benzoyl]-3,4,5-trimethoxy-benzohydrazide Formula: C22H27N3O7S MolecularWeight: 477.53068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=C(C=C(C=C1)C(=O)NNC(=O)C2=CC(=C(C(=C2)OC)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCSC1=C(C=C(C=C1)C(=O)NNC(=O)C2=CC(=C(C(=C2)OC)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H27N3O7S/c1-13(2)8-9-33-19-7-6-14(10-16(19)25(28)29)21(26)23-24-22(27)15-11-17(30-3)20(32-5)18(12-15)31-4/h6-7,10-13H,8-9H2,1-5H3,(H,23,26)(H,24,27)