4-bromanyl-N'-[2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]ethanoyl]-1-methyl-pyrrole-2-carbohydrazide

Systemtic Name: 4-bromanyl-N'-[2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]ethanoyl]-1-methyl-pyrrole-2-carbohydrazide Openeye Name: 4-bromo-N'-[2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]acetyl]-1-methyl-pyrrole-2-carbohydrazide CAS Name: 4-bromo-N'-[2-[(4-methoxy-3-nitrophenyl)methylthio]-1-oxoethyl]-1-methyl-2-pyrrolecarbohydrazide IUPAC Name: 4-bromo-N'-[2-[(4-methoxy-3-nitrophenyl)methylsulfanyl]acetyl]-1-methylpyrrole-2-carbohydrazide Traditional Name: 4-bromo-N'-[2-[(4-methoxy-3-nitro-benzyl)thio]acetyl]-1-methyl-pyrrole-2-carbohydrazide Formula: C16H17BrN4O5S MolecularWeight: 457.29898

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NNC(=O)CSCC2=CC(=C(C=C2)OC)[N+](=O)[O-])Br

Isomeric SMILES

CN1C=C(C=C1C(=O)NNC(=O)CSCC2=CC(=C(C=C2)OC)[N+](=O)[O-])Br

InChI

InChI=1S/C16H17BrN4O5S/c1-20-7-11(17)6-13(20)16(23)19-18-15(22)9-27-8-10-3-4-14(26-2)12(5-10)21(24)25/h3-7H,8-9H2,1-2H3,(H,18,22)(H,19,23)