2-[bis(fluoranyl)methylsulfanyl]-N-[1-(phenylmethyl)pyrrolidin-3-yl]pyridine-3-carboxamide

Systemtic Name: 2-[bis(fluoranyl)methylsulfanyl]-N-[1-(phenylmethyl)pyrrolidin-3-yl]pyridine-3-carboxamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-2-(difluoromethylsulfanyl)pyridine-3-carboxamide CAS Name: 2-(difluoromethylthio)-N-[1-(phenylmethyl)-3-pyrrolidinyl]-3-pyridinecarboxamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-2-(difluoromethylsulfanyl)pyridine-3-carboxamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-2-(difluoromethylthio)nicotinamide Formula: C18H19F2N3OS MolecularWeight: 363.424766

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1NC(=O)C2=C(N=CC=C2)SC(F)F)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CC1NC(=O)C2=C(N=CC=C2)SC(F)F)CC3=CC=CC=C3

InChI

InChI=1S/C18H19F2N3OS/c19-18(20)25-17-15(7-4-9-21-17)16(24)22-14-8-10-23(12-14)11-13-5-2-1-3-6-13/h1-7,9,14,18H,8,10-12H2,(H,22,24)