N'-[3-nitro-4-(oxolan-2-ylmethylsulfanyl)phenyl]carbonylpyridine-4-carbohydrazide

Systemtic Name: N'-[3-nitro-4-(oxolan-2-ylmethylsulfanyl)phenyl]carbonylpyridine-4-carbohydrazide Openeye Name: N'-[3-nitro-4-(tetrahydrofuran-2-ylmethylsulfanyl)benzoyl]pyridine-4-carbohydrazide CAS Name: N'-[[3-nitro-4-(2-oxolanylmethylthio)phenyl]-oxomethyl]-4-pyridinecarbohydrazide IUPAC Name: N'-[3-nitro-4-(oxolan-2-ylmethylsulfanyl)benzoyl]pyridine-4-carbohydrazide Traditional Name: N'-[3-nitro-4-(tetrahydrofurfurylthio)benzoyl]isonicotinohydrazide Formula: C18H18N4O5S MolecularWeight: 402.42432

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CSC2=C(C=C(C=C2)C(=O)NNC(=O)C3=CC=NC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC(OC1)CSC2=C(C=C(C=C2)C(=O)NNC(=O)C3=CC=NC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O5S/c23-17(12-5-7-19-8-6-12)20-21-18(24)13-3-4-16(15(10-13)22(25)26)28-11-14-2-1-9-27-14/h3-8,10,14H,1-2,9,11H2,(H,20,23)(H,21,24)