N-[3-(2-methylpyrimidin-4-yl)phenyl]adamantane-1-carboxamide

Systemtic Name: N-[3-(2-methylpyrimidin-4-yl)phenyl]adamantane-1-carboxamide Openeye Name: N-[3-(2-methylpyrimidin-4-yl)phenyl]adamantane-1-carboxamide CAS Name: N-[3-(2-methyl-4-pyrimidinyl)phenyl]-1-adamantanecarboxamide IUPAC Name: N-[3-(2-methylpyrimidin-4-yl)phenyl]adamantane-1-carboxamide Traditional Name: N-[3-(2-methylpyrimidin-4-yl)phenyl]adamantane-1-carboxamide Formula: C22H25N3O MolecularWeight: 347.4534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=N1)C2=CC(=CC=C2)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=NC=CC(=N1)C2=CC(=CC=C2)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H25N3O/c1-14-23-6-5-20(24-14)18-3-2-4-19(10-18)25-21(26)22-11-15-7-16(12-22)9-17(8-15)13-22/h2-6,10,15-17H,7-9,11-13H2,1H3,(H,25,26)