N-[2-(1-adamantylcarbamoylamino)ethyl]-2-[(2-fluoranylphenoxy)methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-[2-(1-adamantylcarbamoylamino)ethyl]-2-[(2-fluoranylphenoxy)methyl]-1,3-thiazole-4-carboxamide Openeye Name: N-[2-(1-adamantylcarbamoylamino)ethyl]-2-[(2-fluorophenoxy)methyl]thiazole-4-carboxamide CAS Name: N-[2-[[(1-adamantylamino)-oxomethyl]amino]ethyl]-2-[(2-fluorophenoxy)methyl]-4-thiazolecarboxamide IUPAC Name: N-[2-(1-adamantylcarbamoylamino)ethyl]-2-[(2-fluorophenoxy)methyl]-1,3-thiazole-4-carboxamide Traditional Name: N-[2-(1-adamantylcarbamoylamino)ethyl]-2-[(2-fluorophenoxy)methyl]thiazole-4-carboxamide Formula: C24H29FN4O3S MolecularWeight: 472.575463

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)NCCNC(=O)C4=CSC(=N4)COC5=CC=CC=C5F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)NCCNC(=O)C4=CSC(=N4)COC5=CC=CC=C5F

InChI

InChI=1S/C24H29FN4O3S/c25-18-3-1-2-4-20(18)32-13-21-28-19(14-33-21)22(30)26-5-6-27-23(31)29-24-10-15-7-16(11-24)9-17(8-15)12-24/h1-4,14-17H,5-13H2,(H,26,30)(H2,27,29,31)