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

Systemtic Name: N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[4-(difluoromethylsulfanyl)phenyl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[4-(difluoromethylthio)phenyl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[4-(difluoromethylsulfanyl)phenyl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[4-(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=C(C=C3)SC(F)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)SC(F)F

InChI

InChI=1S/C18H18F2N2O3S2/c19-18(20)26-15-7-5-14(6-8-15)21-17(23)13-3-9-16(10-4-13)27(24,25)22-11-1-2-12-22/h3-10,18H,1-2,11-12H2,(H,21,23)