4-bromanyl-N'-[2-[[5-(furan-2-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]benzohydrazide

Systemtic Name: 4-bromanyl-N'-[2-[[5-(furan-2-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]benzohydrazide Openeye Name: 4-bromo-N'-[2-[[5-(2-furyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]benzohydrazide CAS Name: 4-bromo-N'-[2-[[5-(2-furanyl)-4-phenyl-1,2,4-triazol-3-yl]thio]-1-oxoethyl]benzohydrazide IUPAC Name: 4-bromo-N'-[2-[[5-(furan-2-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]benzohydrazide Traditional Name: 4-bromo-N'-[2-[[5-(2-furyl)-4-phenyl-1,2,4-triazol-3-yl]thio]acetyl]benzohydrazide Formula: C21H16BrN5O3S MolecularWeight: 498.35244

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NNC(=O)C3=CC=C(C=C3)Br)C4=CC=CO4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NNC(=O)C3=CC=C(C=C3)Br)C4=CC=CO4

InChI

InChI=1S/C21H16BrN5O3S/c22-15-10-8-14(9-11-15)20(29)25-23-18(28)13-31-21-26-24-19(17-7-4-12-30-17)27(21)16-5-2-1-3-6-16/h1-12H,13H2,(H,23,28)(H,25,29)