N'-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoyl]-2,5-dimethyl-1-phenyl-pyrrole-3-carbohydrazide

Systemtic Name: N'-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoyl]-2,5-dimethyl-1-phenyl-pyrrole-3-carbohydrazide Openeye Name: N'-[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]-2,5-dimethyl-1-phenyl-pyrrole-3-carbohydrazide CAS Name: N'-[2-(1,3-benzothiazol-2-ylthio)-1-oxoethyl]-2,5-dimethyl-1-phenyl-3-pyrrolecarbohydrazide IUPAC Name: N'-[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]-2,5-dimethyl-1-phenylpyrrole-3-carbohydrazide Traditional Name: N'-[2-(1,3-benzothiazol-2-ylthio)acetyl]-2,5-dimethyl-1-phenyl-pyrrole-3-carbohydrazide Formula: C22H20N4O2S2 MolecularWeight: 436.5498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=C2)C)C(=O)NNC(=O)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=C2)C)C(=O)NNC(=O)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H20N4O2S2/c1-14-12-17(15(2)26(14)16-8-4-3-5-9-16)21(28)25-24-20(27)13-29-22-23-18-10-6-7-11-19(18)30-22/h3-12H,13H2,1-2H3,(H,24,27)(H,25,28)