N-[2-[bis(fluoranyl)methylsulfanyl]phenyl]-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-[bis(fluoranyl)methylsulfanyl]phenyl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(difluoromethylsulfanyl)phenyl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-(difluoromethylthio)phenyl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[2-(difluoromethylsulfanyl)phenyl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(difluoromethylthio)phenyl]-4-pyrrolidinosulfonyl-benzamide Formula: C18H18F2N2O3S2 MolecularWeight: 412.473926

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3SC(F)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3SC(F)F

InChI

InChI=1S/C18H18F2N2O3S2/c19-18(20)26-16-6-2-1-5-15(16)21-17(23)13-7-9-14(10-8-13)27(24,25)22-11-3-4-12-22/h1-2,5-10,18H,3-4,11-12H2,(H,21,23)