4-fluoranyl-N-[4-[3-(4-methylphenyl)-1-adamantyl]-1,3-thiazol-2-yl]benzamide

Systemtic Name: 4-fluoranyl-N-[4-[3-(4-methylphenyl)-1-adamantyl]-1,3-thiazol-2-yl]benzamide Openeye Name: 4-fluoro-N-[4-[3-(p-tolyl)-1-adamantyl]thiazol-2-yl]benzamide CAS Name: 4-fluoro-N-[4-[3-(4-methylphenyl)-1-adamantyl]-2-thiazolyl]benzamide IUPAC Name: 4-fluoro-N-[4-[3-(4-methylphenyl)-1-adamantyl]-1,3-thiazol-2-yl]benzamide Traditional Name: 4-fluoro-N-[4-[3-(p-tolyl)-1-adamantyl]thiazol-2-yl]benzamide Formula: C27H27FN2OS MolecularWeight: 446.579483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C5=CSC(=N5)NC(=O)C6=CC=C(C=C6)F

Isomeric SMILES

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C5=CSC(=N5)NC(=O)C6=CC=C(C=C6)F

InChI

InChI=1S/C27H27FN2OS/c1-17-2-6-21(7-3-17)26-11-18-10-19(12-26)14-27(13-18,16-26)23-15-32-25(29-23)30-24(31)20-4-8-22(28)9-5-20/h2-9,15,18-19H,10-14,16H2,1H3,(H,29,30,31)