N-(6-chloranyl-1,3-benzothiazol-2-yl)-1-(3-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-1-(3-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-1-(3-methylsulfanylphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-1-[3-(methylthio)phenyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-1-(3-methylsulfanylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-5-keto-1-[3-(methylthio)phenyl]pyrrolidine-3-carboxamide Formula: C19H16ClN3O2S2 MolecularWeight: 417.93224

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)N2CC(CC2=O)C(=O)NC3=NC4=C(S3)C=C(C=C4)Cl

Isomeric SMILES

CSC1=CC=CC(=C1)N2CC(CC2=O)C(=O)NC3=NC4=C(S3)C=C(C=C4)Cl

InChI

InChI=1S/C19H16ClN3O2S2/c1-26-14-4-2-3-13(9-14)23-10-11(7-17(23)24)18(25)22-19-21-15-6-5-12(20)8-16(15)27-19/h2-6,8-9,11H,7,10H2,1H3,(H,21,22,25)