N-(1,3-benzothiazol-2-yl)-N-methyl-1-(3-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-methyl-1-(3-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-methyl-1-(3-methylsulfanylphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-methyl-1-[3-(methylthio)phenyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-methyl-1-(3-methylsulfanylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-5-keto-N-methyl-1-[3-(methylthio)phenyl]pyrrolidine-3-carboxamide Formula: C20H19N3O2S2 MolecularWeight: 397.51376

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=NC2=CC=CC=C2S1)C(=O)C3CC(=O)N(C3)C4=CC(=CC=C4)SC

Isomeric SMILES

CN(C1=NC2=CC=CC=C2S1)C(=O)C3CC(=O)N(C3)C4=CC(=CC=C4)SC

InChI

InChI=1S/C20H19N3O2S2/c1-22(20-21-16-8-3-4-9-17(16)27-20)19(25)13-10-18(24)23(12-13)14-6-5-7-15(11-14)26-2/h3-9,11,13H,10,12H2,1-2H3