4-bromanyl-N'-[4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)phenyl]carbonyl-1H-pyrrole-2-carbohydrazide

Systemtic Name: 4-bromanyl-N'-[4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)phenyl]carbonyl-1H-pyrrole-2-carbohydrazide Openeye Name: 4-bromo-N'-[4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzoyl]-1H-pyrrole-2-carbohydrazide CAS Name: 4-bromo-N'-[oxo-[4-[(1H-1,2,4-triazol-5-ylthio)methyl]phenyl]methyl]-1H-pyrrole-2-carbohydrazide IUPAC Name: 4-bromo-N'-[4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzoyl]-1H-pyrrole-2-carbohydrazide Traditional Name: 4-bromo-N'-[4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzoyl]-1H-pyrrole-2-carbohydrazide Formula: C15H13BrN6O2S MolecularWeight: 421.27172

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=NC=NN2)C(=O)NNC(=O)C3=CC(=CN3)Br

Isomeric SMILES

C1=CC(=CC=C1CSC2=NC=NN2)C(=O)NNC(=O)C3=CC(=CN3)Br

InChI

InChI=1S/C15H13BrN6O2S/c16-11-5-12(17-6-11)14(24)21-20-13(23)10-3-1-9(2-4-10)7-25-15-18-8-19-22-15/h1-6,8,17H,7H2,(H,20,23)(H,21,24)(H,18,19,22)