2-tert-butyl-N-[phenyl(pyridin-3-yl)methyl]pyrimidine-5-carboxamide

Systemtic Name: 2-tert-butyl-N-[phenyl(pyridin-3-yl)methyl]pyrimidine-5-carboxamide Openeye Name: 2-tert-butyl-N-[phenyl(3-pyridyl)methyl]pyrimidine-5-carboxamide CAS Name: 2-tert-butyl-N-[phenyl(3-pyridinyl)methyl]-5-pyrimidinecarboxamide IUPAC Name: 2-tert-butyl-N-[phenyl(pyridin-3-yl)methyl]pyrimidine-5-carboxamide Traditional Name: 2-tert-butyl-N-[phenyl(3-pyridyl)methyl]pyrimidine-5-carboxamide Formula: C21H22N4O MolecularWeight: 346.42558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC=C(C=N1)C(=O)NC(C2=CC=CC=C2)C3=CN=CC=C3

Isomeric SMILES

CC(C)(C)C1=NC=C(C=N1)C(=O)NC(C2=CC=CC=C2)C3=CN=CC=C3

InChI

InChI=1S/C21H22N4O/c1-21(2,3)20-23-13-17(14-24-20)19(26)25-18(15-8-5-4-6-9-15)16-10-7-11-22-12-16/h4-14,18H,1-3H3,(H,25,26)