N-[2-[2,2-bis(fluoranyl)ethylsulfanyl]-1,3-benzothiazol-6-yl]-1-(2,2-dimethylpropanoyl)pyrrolidine-2-carboxamide

Systemtic Name: N-[2-[2,2-bis(fluoranyl)ethylsulfanyl]-1,3-benzothiazol-6-yl]-1-(2,2-dimethylpropanoyl)pyrrolidine-2-carboxamide Openeye Name: N-[2-(2,2-difluoroethylsulfanyl)-1,3-benzothiazol-6-yl]-1-(2,2-dimethylpropanoyl)pyrrolidine-2-carboxamide CAS Name: N-[2-(2,2-difluoroethylthio)-1,3-benzothiazol-6-yl]-1-(2,2-dimethyl-1-oxopropyl)-2-pyrrolidinecarboxamide IUPAC Name: N-[2-(2,2-difluoroethylsulfanyl)-1,3-benzothiazol-6-yl]-1-(2,2-dimethylpropanoyl)pyrrolidine-2-carboxamide Traditional Name: N-[2-(2,2-difluoroethylthio)-1,3-benzothiazol-6-yl]-1-pivaloyl-pyrrolidine-2-carboxamide Formula: C19H23F2N3O2S2 MolecularWeight: 427.531626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N1CCCC1C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(F)F

Isomeric SMILES

CC(C)(C)C(=O)N1CCCC1C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(F)F

InChI

InChI=1S/C19H23F2N3O2S2/c1-19(2,3)17(26)24-8-4-5-13(24)16(25)22-11-6-7-12-14(9-11)28-18(23-12)27-10-15(20)21/h6-7,9,13,15H,4-5,8,10H2,1-3H3,(H,22,25)