N'-(2-bromophenyl)carbonyl-3-nitro-4-(oxolan-2-ylmethylsulfanyl)benzohydrazide

Systemtic Name: N'-(2-bromophenyl)carbonyl-3-nitro-4-(oxolan-2-ylmethylsulfanyl)benzohydrazide Openeye Name: N'-(2-bromobenzoyl)-3-nitro-4-(tetrahydrofuran-2-ylmethylsulfanyl)benzohydrazide CAS Name: N'-[(2-bromophenyl)-oxomethyl]-3-nitro-4-(2-oxolanylmethylthio)benzohydrazide IUPAC Name: N'-(2-bromobenzoyl)-3-nitro-4-(oxolan-2-ylmethylsulfanyl)benzohydrazide Traditional Name: N'-(2-bromobenzoyl)-3-nitro-4-(tetrahydrofurfurylthio)benzohydrazide Formula: C19H18BrN3O5S MolecularWeight: 480.33232

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CSC2=C(C=C(C=C2)C(=O)NNC(=O)C3=CC=CC=C3Br)[N+](=O)[O-]

Isomeric SMILES

C1CC(OC1)CSC2=C(C=C(C=C2)C(=O)NNC(=O)C3=CC=CC=C3Br)[N+](=O)[O-]

InChI

InChI=1S/C19H18BrN3O5S/c20-15-6-2-1-5-14(15)19(25)22-21-18(24)12-7-8-17(16(10-12)23(26)27)29-11-13-4-3-9-28-13/h1-2,5-8,10,13H,3-4,9,11H2,(H,21,24)(H,22,25)