N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-3,5,7-trimethyl-adamantane-1-carboxamide

Systemtic Name: N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-3,5,7-trimethyl-adamantane-1-carboxamide Openeye Name: N-[4-(difluoromethylsulfanyl)phenyl]-3,5,7-trimethyl-adamantane-1-carboxamide CAS Name: N-[4-(difluoromethylthio)phenyl]-3,5,7-trimethyl-1-adamantanecarboxamide IUPAC Name: N-[4-(difluoromethylsulfanyl)phenyl]-3,5,7-trimethyladamantane-1-carboxamide Traditional Name: N-[4-(difluoromethylthio)phenyl]-3,5,7-trimethyl-adamantane-1-carboxamide Formula: C21H27F2NOS MolecularWeight: 379.506986

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3(CC(C1)(CC(C2)(C3)C(=O)NC4=CC=C(C=C4)SC(F)F)C)C

Isomeric SMILES

CC12CC3(CC(C1)(CC(C2)(C3)C(=O)NC4=CC=C(C=C4)SC(F)F)C)C

InChI

InChI=1S/C21H27F2NOS/c1-18-8-19(2)10-20(3,9-18)13-21(11-18,12-19)16(25)24-14-4-6-15(7-5-14)26-17(22)23/h4-7,17H,8-13H2,1-3H3,(H,24,25)