N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[4-(difluoromethylsulfanyl)phenyl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[4-(difluoromethylthio)phenyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[4-(difluoromethylsulfanyl)phenyl]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[4-(difluoromethylthio)phenyl]-3-pyrrolidinosulfonyl-benzamide Formula: C18H18F2N2O3S2 MolecularWeight: 412.473926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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