N'-[2-(4-fluorophenyl)ethanoyl]-4-(3-methylbutylsulfanyl)-3-nitro-benzohydrazide

Systemtic Name: N'-[2-(4-fluorophenyl)ethanoyl]-4-(3-methylbutylsulfanyl)-3-nitro-benzohydrazide Openeye Name: N'-[2-(4-fluorophenyl)acetyl]-4-isopentylsulfanyl-3-nitro-benzohydrazide CAS Name: N'-[2-(4-fluorophenyl)-1-oxoethyl]-4-(3-methylbutylthio)-3-nitrobenzohydrazide IUPAC Name: N'-[2-(4-fluorophenyl)acetyl]-4-(3-methylbutylsulfanyl)-3-nitrobenzohydrazide Traditional Name: N'-[2-(4-fluorophenyl)acetyl]-4-(isoamylthio)-3-nitro-benzohydrazide Formula: C20H22FN3O4S MolecularWeight: 419.469783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=C(C=C(C=C1)C(=O)NNC(=O)CC2=CC=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCSC1=C(C=C(C=C1)C(=O)NNC(=O)CC2=CC=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C20H22FN3O4S/c1-13(2)9-10-29-18-8-5-15(12-17(18)24(27)28)20(26)23-22-19(25)11-14-3-6-16(21)7-4-14/h3-8,12-13H,9-11H2,1-2H3,(H,22,25)(H,23,26)