N'-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoyl]-1-[(4-methylphenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carbohydrazide

Systemtic Name: N'-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoyl]-1-[(4-methylphenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carbohydrazide Openeye Name: N'-[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]-5-oxo-1-(p-tolylmethyl)pyrrolidine-3-carbohydrazide CAS Name: N'-[2-(1,3-benzothiazol-2-ylthio)-1-oxoethyl]-1-[(4-methylphenyl)methyl]-5-oxo-3-pyrrolidinecarbohydrazide IUPAC Name: N'-[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]-1-[(4-methylphenyl)methyl]-5-oxopyrrolidine-3-carbohydrazide Traditional Name: N'-[2-(1,3-benzothiazol-2-ylthio)acetyl]-5-keto-1-(4-methylbenzyl)pyrrolidine-3-carbohydrazide Formula: C22H22N4O3S2 MolecularWeight: 454.56508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CC(CC2=O)C(=O)NNC(=O)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=C(C=C1)CN2CC(CC2=O)C(=O)NNC(=O)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H22N4O3S2/c1-14-6-8-15(9-7-14)11-26-12-16(10-20(26)28)21(29)25-24-19(27)13-30-22-23-17-4-2-3-5-18(17)31-22/h2-9,16H,10-13H2,1H3,(H,24,27)(H,25,29)