N-(2-adamantyl)-2-[(4-fluoranylphenoxy)methyl]-4-methyl-1,3-thiazole-5-carboxamide

Systemtic Name: N-(2-adamantyl)-2-[(4-fluoranylphenoxy)methyl]-4-methyl-1,3-thiazole-5-carboxamide Openeye Name: N-(2-adamantyl)-2-[(4-fluorophenoxy)methyl]-4-methyl-thiazole-5-carboxamide CAS Name: N-(2-adamantyl)-2-[(4-fluorophenoxy)methyl]-4-methyl-5-thiazolecarboxamide IUPAC Name: N-(2-adamantyl)-2-[(4-fluorophenoxy)methyl]-4-methyl-1,3-thiazole-5-carboxamide Traditional Name: N-(2-adamantyl)-2-[(4-fluorophenoxy)methyl]-4-methyl-thiazole-5-carboxamide Formula: C22H25FN2O2S MolecularWeight: 400.509503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)COC2=CC=C(C=C2)F)C(=O)NC3C4CC5CC(C4)CC3C5

Isomeric SMILES

CC1=C(SC(=N1)COC2=CC=C(C=C2)F)C(=O)NC3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C22H25FN2O2S/c1-12-21(28-19(24-12)11-27-18-4-2-17(23)3-5-18)22(26)25-20-15-7-13-6-14(9-15)10-16(20)8-13/h2-5,13-16,20H,6-11H2,1H3,(H,25,26)