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

Systemtic Name: N-[2-[2,2-bis(fluoranyl)ethylsulfanyl]-1,3-benzothiazol-6-yl]-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: N-[2-(2,2-difluoroethylsulfanyl)-1,3-benzothiazol-6-yl]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide CAS Name: N-[2-(2,2-difluoroethylthio)-1,3-benzothiazol-6-yl]-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[2-(2,2-difluoroethylsulfanyl)-1,3-benzothiazol-6-yl]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide Traditional Name: N-[2-(2,2-difluoroethylthio)-1,3-benzothiazol-6-yl]-1-(2-thenoyl)pyrrolidine-2-carboxamide Formula: C19H17F2N3O2S3 MolecularWeight: 453.548986

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC=CS2)C(=O)NC3=CC4=C(C=C3)N=C(S4)SCC(F)F

Isomeric SMILES

C1CC(N(C1)C(=O)C2=CC=CS2)C(=O)NC3=CC4=C(C=C3)N=C(S4)SCC(F)F

InChI

InChI=1S/C19H17F2N3O2S3/c20-16(21)10-28-19-23-12-6-5-11(9-15(12)29-19)22-17(25)13-3-1-7-24(13)18(26)14-4-2-8-27-14/h2,4-6,8-9,13,16H,1,3,7,10H2,(H,22,25)