5-[[3-[3-(1-adamantyl)-5-fluoranyl-4-oxidanyl-phenyl]phenyl]methyl]-2-pyrrolidin-3-yl-1,3-thiazol-4-one

Systemtic Name: 5-[[3-[3-(1-adamantyl)-5-fluoranyl-4-oxidanyl-phenyl]phenyl]methyl]-2-pyrrolidin-3-yl-1,3-thiazol-4-one Openeye Name: 5-[[3-[3-(1-adamantyl)-5-fluoro-4-hydroxy-phenyl]phenyl]methyl]-2-pyrrolidin-3-yl-thiazol-4-one CAS Name: 5-[[3-[3-(1-adamantyl)-5-fluoro-4-hydroxyphenyl]phenyl]methyl]-2-(3-pyrrolidinyl)-4-thiazolone IUPAC Name: 5-[[3-[3-(1-adamantyl)-5-fluoro-4-hydroxyphenyl]phenyl]methyl]-2-pyrrolidin-3-yl-1,3-thiazol-4-one Traditional Name: 5-[3-[3-(1-adamantyl)-5-fluoro-4-hydroxy-phenyl]benzyl]-2-pyrrolidin-3-yl-2-thiazolin-4-one Formula: C30H33FN2O2S MolecularWeight: 504.658623

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC1C2=NC(=O)C(S2)CC3=CC=CC(=C3)C4=CC(=C(C(=C4)F)O)C56CC7CC(C5)CC(C7)C6

Isomeric SMILES

C1CNCC1C2=NC(=O)C(S2)CC3=CC=CC(=C3)C4=CC(=C(C(=C4)F)O)C56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C30H33FN2O2S/c31-25-12-23(11-24(27(25)34)30-13-18-6-19(14-30)8-20(7-18)15-30)21-3-1-2-17(9-21)10-26-28(35)33-29(36-26)22-4-5-32-16-22/h1-3,9,11-12,18-20,22,26,32,34H,4-8,10,13-16H2