4-bromanyl-N'-[2-(2,5-dimethylphenyl)sulfanylethanoyl]-1H-pyrrole-2-carbohydrazide

Systemtic Name: 4-bromanyl-N'-[2-(2,5-dimethylphenyl)sulfanylethanoyl]-1H-pyrrole-2-carbohydrazide Openeye Name: 4-bromo-N'-[2-(2,5-dimethylphenyl)sulfanylacetyl]-1H-pyrrole-2-carbohydrazide CAS Name: 4-bromo-N'-[2-[(2,5-dimethylphenyl)thio]-1-oxoethyl]-1H-pyrrole-2-carbohydrazide IUPAC Name: 4-bromo-N'-[2-(2,5-dimethylphenyl)sulfanylacetyl]-1H-pyrrole-2-carbohydrazide Traditional Name: 4-bromo-N'-[2-[(2,5-dimethylphenyl)thio]acetyl]-1H-pyrrole-2-carbohydrazide Formula: C15H16BrN3O2S MolecularWeight: 382.27544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SCC(=O)NNC(=O)C2=CC(=CN2)Br

Isomeric SMILES

CC1=CC(=C(C=C1)C)SCC(=O)NNC(=O)C2=CC(=CN2)Br

InChI

InChI=1S/C15H16BrN3O2S/c1-9-3-4-10(2)13(5-9)22-8-14(20)18-19-15(21)12-6-11(16)7-17-12/h3-7,17H,8H2,1-2H3,(H,18,20)(H,19,21)