N'-[2-(1,3-benzothiazol-2-ylamino)ethanoyl]-1-(3-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidine-3-carbohydrazide

Systemtic Name: N'-[2-(1,3-benzothiazol-2-ylamino)ethanoyl]-1-(3-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidine-3-carbohydrazide Openeye Name: N'-[2-(1,3-benzothiazol-2-ylamino)acetyl]-1-(3-methylsulfanylphenyl)-5-oxo-pyrrolidine-3-carbohydrazide CAS Name: N'-[2-(1,3-benzothiazol-2-ylamino)-1-oxoethyl]-1-[3-(methylthio)phenyl]-5-oxo-3-pyrrolidinecarbohydrazide IUPAC Name: N'-[2-(1,3-benzothiazol-2-ylamino)acetyl]-1-(3-methylsulfanylphenyl)-5-oxopyrrolidine-3-carbohydrazide Traditional Name: N'-[2-(1,3-benzothiazol-2-ylamino)acetyl]-5-keto-1-[3-(methylthio)phenyl]pyrrolidine-3-carbohydrazide Formula: C21H21N5O3S2 MolecularWeight: 455.55314

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)N2CC(CC2=O)C(=O)NNC(=O)CNC3=NC4=CC=CC=C4S3

Isomeric SMILES

CSC1=CC=CC(=C1)N2CC(CC2=O)C(=O)NNC(=O)CNC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H21N5O3S2/c1-30-15-6-4-5-14(10-15)26-12-13(9-19(26)28)20(29)25-24-18(27)11-22-21-23-16-7-2-3-8-17(16)31-21/h2-8,10,13H,9,11-12H2,1H3,(H,22,23)(H,24,27)(H,25,29)