N-[5-[(1-adamantylcarbonylamino)carbamoyl]-2-methyl-phenyl]-2-fluoranyl-benzamide

Systemtic Name: N-[5-[(1-adamantylcarbonylamino)carbamoyl]-2-methyl-phenyl]-2-fluoranyl-benzamide Openeye Name: N-[5-[(adamantane-1-carbonylamino)carbamoyl]-2-methyl-phenyl]-2-fluoro-benzamide CAS Name: N-[5-[[[1-adamantyl(oxo)methyl]hydrazo]-oxomethyl]-2-methylphenyl]-2-fluorobenzamide IUPAC Name: N-[5-[(adamantane-1-carbonylamino)carbamoyl]-2-methylphenyl]-2-fluorobenzamide Traditional Name: N-[5-[(adamantane-1-carbonylamino)carbamoyl]-2-methyl-phenyl]-2-fluoro-benzamide Formula: C26H28FN3O3 MolecularWeight: 449.517223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NNC(=O)C23CC4CC(C2)CC(C4)C3)NC(=O)C5=CC=CC=C5F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NNC(=O)C23CC4CC(C2)CC(C4)C3)NC(=O)C5=CC=CC=C5F

InChI

InChI=1S/C26H28FN3O3/c1-15-6-7-19(11-22(15)28-24(32)20-4-2-3-5-21(20)27)23(31)29-30-25(33)26-12-16-8-17(13-26)10-18(9-16)14-26/h2-7,11,16-18H,8-10,12-14H2,1H3,(H,28,32)(H,29,31)(H,30,33)