4-bromanyl-1-methyl-N'-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-phenyl]carbonyl-pyrrole-2-carbohydrazide

Systemtic Name: 4-bromanyl-1-methyl-N'-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-phenyl]carbonyl-pyrrole-2-carbohydrazide Openeye Name: 4-bromo-1-methyl-N'-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-benzoyl]pyrrole-2-carbohydrazide CAS Name: 4-bromo-1-methyl-N'-[[4-[(4-methyl-1,2,4-triazol-3-yl)thio]-3-nitrophenyl]-oxomethyl]-2-pyrrolecarbohydrazide IUPAC Name: 4-bromo-1-methyl-N'-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitrobenzoyl]pyrrole-2-carbohydrazide Traditional Name: 4-bromo-1-methyl-N'-[4-[(4-methyl-1,2,4-triazol-3-yl)thio]-3-nitro-benzoyl]pyrrole-2-carbohydrazide Formula: C16H14BrN7O4S MolecularWeight: 480.29586

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NNC(=O)C2=CC(=C(C=C2)SC3=NN=CN3C)[N+](=O)[O-])Br

Isomeric SMILES

CN1C=C(C=C1C(=O)NNC(=O)C2=CC(=C(C=C2)SC3=NN=CN3C)[N+](=O)[O-])Br

InChI

InChI=1S/C16H14BrN7O4S/c1-22-7-10(17)6-12(22)15(26)20-19-14(25)9-3-4-13(11(5-9)24(27)28)29-16-21-18-8-23(16)2/h3-8H,1-2H3,(H,19,25)(H,20,26)