4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N'-[2-(3,5-dimethylpyrazol-1-yl)ethanoyl]benzohydrazide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N'-[2-(3,5-dimethylpyrazol-1-yl)ethanoyl]benzohydrazide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]benzohydrazide CAS Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N'-[2-(3,5-dimethyl-1-pyrazolyl)-1-oxoethyl]benzohydrazide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]benzohydrazide Traditional Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]benzohydrazide Formula: C22H21N5O2S2 MolecularWeight: 451.56444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC(=O)NNC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CC1=CC(=NN1CC(=O)NNC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C22H21N5O2S2/c1-14-11-15(2)27(26-14)12-20(28)24-25-21(29)17-9-7-16(8-10-17)13-30-22-23-18-5-3-4-6-19(18)31-22/h3-11H,12-13H2,1-2H3,(H,24,28)(H,25,29)