1-(2,3-dimethylphenyl)-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: 1-(2,3-dimethylphenyl)-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: 1-(2,3-dimethylphenyl)-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: 1-(2,3-dimethylphenyl)-N-[2-(methylthio)-1,3-benzothiazol-6-yl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: 1-(2,3-dimethylphenyl)-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-5-oxopyrrolidine-3-carboxamide Traditional Name: 1-(2,3-dimethylphenyl)-5-keto-N-[2-(methylthio)-1,3-benzothiazol-6-yl]pyrrolidine-3-carboxamide Formula: C21H21N3O2S2 MolecularWeight: 411.54034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CC(CC2=O)C(=O)NC3=CC4=C(C=C3)N=C(S4)SC)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CC(CC2=O)C(=O)NC3=CC4=C(C=C3)N=C(S4)SC)C

InChI

InChI=1S/C21H21N3O2S2/c1-12-5-4-6-17(13(12)2)24-11-14(9-19(24)25)20(26)22-15-7-8-16-18(10-15)28-21(23-16)27-3/h4-8,10,14H,9,11H2,1-3H3,(H,22,26)