N-[2-[[2-(4-fluorophenyl)-1H-indol-3-yl]sulfanyl]ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-[[2-(4-fluorophenyl)-1H-indol-3-yl]sulfanyl]ethyl]adamantane-1-carboxamide Openeye Name: N-[2-[[2-(4-fluorophenyl)-1H-indol-3-yl]sulfanyl]ethyl]adamantane-1-carboxamide CAS Name: N-[2-[[2-(4-fluorophenyl)-1H-indol-3-yl]thio]ethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[[2-(4-fluorophenyl)-1H-indol-3-yl]sulfanyl]ethyl]adamantane-1-carboxamide Traditional Name: N-[2-[[2-(4-fluorophenyl)-1H-indol-3-yl]thio]ethyl]adamantane-1-carboxamide Formula: C27H29FN2OS MolecularWeight: 448.595363

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCCSC4=C(NC5=CC=CC=C54)C6=CC=C(C=C6)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCCSC4=C(NC5=CC=CC=C54)C6=CC=C(C=C6)F

InChI

InChI=1S/C27H29FN2OS/c28-21-7-5-20(6-8-21)24-25(22-3-1-2-4-23(22)30-24)32-10-9-29-26(31)27-14-17-11-18(15-27)13-19(12-17)16-27/h1-8,17-19,30H,9-16H2,(H,29,31)