2-methyl-N-[3-(pyridin-2-ylcarbonylamino)-1-adamantyl]pyrimidine-4-carboxamide

Systemtic Name: 2-methyl-N-[3-(pyridin-2-ylcarbonylamino)-1-adamantyl]pyrimidine-4-carboxamide Openeye Name: 2-methyl-N-[3-(pyridine-2-carbonylamino)-1-adamantyl]pyrimidine-4-carboxamide CAS Name: 2-methyl-N-[3-[[oxo(2-pyridinyl)methyl]amino]-1-adamantyl]-4-pyrimidinecarboxamide IUPAC Name: 2-methyl-N-[3-(pyridine-2-carbonylamino)-1-adamantyl]pyrimidine-4-carboxamide Traditional Name: 2-methyl-N-(3-picolinamido-1-adamantyl)pyrimidine-4-carboxamide Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=N1)C(=O)NC23CC4CC(C2)CC(C4)(C3)NC(=O)C5=CC=CC=N5

Isomeric SMILES

CC1=NC=CC(=N1)C(=O)NC23CC4CC(C2)CC(C4)(C3)NC(=O)C5=CC=CC=N5

InChI

InChI=1S/C22H25N5O2/c1-14-23-7-5-18(25-14)20(29)27-22-11-15-8-16(12-22)10-21(9-15,13-22)26-19(28)17-4-2-3-6-24-17/h2-7,15-16H,8-13H2,1H3,(H,26,28)(H,27,29)