N-(1-adamantylmethyl)-2-[3,4-bis(fluoranyl)phenyl]sulfanyl-ethanamide

Systemtic Name: N-(1-adamantylmethyl)-2-[3,4-bis(fluoranyl)phenyl]sulfanyl-ethanamide Openeye Name: N-(1-adamantylmethyl)-2-(3,4-difluorophenyl)sulfanyl-acetamide CAS Name: N-(1-adamantylmethyl)-2-[(3,4-difluorophenyl)thio]acetamide IUPAC Name: N-(1-adamantylmethyl)-2-(3,4-difluorophenyl)sulfanylacetamide Traditional Name: N-(1-adamantylmethyl)-2-[(3,4-difluorophenyl)thio]acetamide Formula: C19H23F2NOS MolecularWeight: 351.453826

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC(=O)CSC4=CC(=C(C=C4)F)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC(=O)CSC4=CC(=C(C=C4)F)F

InChI

InChI=1S/C19H23F2NOS/c20-16-2-1-15(6-17(16)21)24-10-18(23)22-11-19-7-12-3-13(8-19)5-14(4-12)9-19/h1-2,6,12-14H,3-5,7-11H2,(H,22,23)