3-(1,3-benzothiazol-2-ylsulfanyl)-1-(3,4-dimethylphenyl)pyrrolidine-2,5-dione

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-1-(3,4-dimethylphenyl)pyrrolidine-2,5-dione Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-1-(3,4-dimethylphenyl)pyrrolidine-2,5-dione CAS Name: 3-(1,3-benzothiazol-2-ylthio)-1-(3,4-dimethylphenyl)pyrrolidine-2,5-dione IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-1-(3,4-dimethylphenyl)pyrrolidine-2,5-dione Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-1-(3,4-dimethylphenyl)pyrrolidine-2,5-quinone Formula: C19H16N2O2S2 MolecularWeight: 368.47254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)CC(C2=O)SC3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)CC(C2=O)SC3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C19H16N2O2S2/c1-11-7-8-13(9-12(11)2)21-17(22)10-16(18(21)23)25-19-20-14-5-3-4-6-15(14)24-19/h3-9,16H,10H2,1-2H3