N'-[2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanylethanoyl]-2-(1-methylbenzimidazol-2-yl)ethanehydrazide

Systemtic Name: N'-[2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanylethanoyl]-2-(1-methylbenzimidazol-2-yl)ethanehydrazide Openeye Name: N'-[2-(4-bromo-2,5-dimethyl-phenyl)sulfanylacetyl]-2-(1-methylbenzimidazol-2-yl)acetohydrazide CAS Name: N'-[2-[(4-bromo-2,5-dimethylphenyl)thio]-1-oxoethyl]-2-(1-methyl-2-benzimidazolyl)acetohydrazide IUPAC Name: N'-[2-(4-bromo-2,5-dimethylphenyl)sulfanylacetyl]-2-(1-methylbenzimidazol-2-yl)acetohydrazide Traditional Name: N'-[2-[(4-bromo-2,5-dimethyl-phenyl)thio]acetyl]-2-(1-methylbenzimidazol-2-yl)acetohydrazide Formula: C20H21BrN4O2S MolecularWeight: 461.37534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C)SCC(=O)NNC(=O)CC2=NC3=CC=CC=C3N2C

Isomeric SMILES

CC1=CC(=C(C=C1Br)C)SCC(=O)NNC(=O)CC2=NC3=CC=CC=C3N2C

InChI

InChI=1S/C20H21BrN4O2S/c1-12-9-17(13(2)8-14(12)21)28-11-20(27)24-23-19(26)10-18-22-15-6-4-5-7-16(15)25(18)3/h4-9H,10-11H2,1-3H3,(H,23,26)(H,24,27)