N'-[2-(4-bromanyl-2-methyl-phenyl)sulfanylethanoyl]-3-methylsulfonyl-benzohydrazide

Systemtic Name: N'-[2-(4-bromanyl-2-methyl-phenyl)sulfanylethanoyl]-3-methylsulfonyl-benzohydrazide Openeye Name: N'-[2-(4-bromo-2-methyl-phenyl)sulfanylacetyl]-3-methylsulfonyl-benzohydrazide CAS Name: N'-[2-[(4-bromo-2-methylphenyl)thio]-1-oxoethyl]-3-methylsulfonylbenzohydrazide IUPAC Name: N'-[2-(4-bromo-2-methylphenyl)sulfanylacetyl]-3-methylsulfonylbenzohydrazide Traditional Name: N'-[2-[(4-bromo-2-methyl-phenyl)thio]acetyl]-3-mesyl-benzohydrazide Formula: C17H17BrN2O4S2 MolecularWeight: 457.36188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17BrN2O4S2/c1-11-8-13(18)6-7-15(11)25-10-16(21)19-20-17(22)12-4-3-5-14(9-12)26(2,23)24/h3-9H,10H2,1-2H3,(H,19,21)(H,20,22)