2-(4-fluorophenyl)-4-[methyl(propan-2-yl)amino]-N-(pyridin-3-ylmethyl)pyrimidine-5-carboxamide

Systemtic Name: 2-(4-fluorophenyl)-4-[methyl(propan-2-yl)amino]-N-(pyridin-3-ylmethyl)pyrimidine-5-carboxamide Openeye Name: 2-(4-fluorophenyl)-4-[isopropyl(methyl)amino]-N-(3-pyridylmethyl)pyrimidine-5-carboxamide CAS Name: 2-(4-fluorophenyl)-4-[methyl(propan-2-yl)amino]-N-(3-pyridinylmethyl)-5-pyrimidinecarboxamide IUPAC Name: 2-(4-fluorophenyl)-4-[methyl(propan-2-yl)amino]-N-(pyridin-3-ylmethyl)pyrimidine-5-carboxamide Traditional Name: 2-(4-fluorophenyl)-4-[isopropyl(methyl)amino]-N-(3-pyridylmethyl)pyrimidine-5-carboxamide Formula: C21H22FN5O MolecularWeight: 379.430683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C)C1=NC(=NC=C1C(=O)NCC2=CN=CC=C2)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)N(C)C1=NC(=NC=C1C(=O)NCC2=CN=CC=C2)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H22FN5O/c1-14(2)27(3)20-18(21(28)25-12-15-5-4-10-23-11-15)13-24-19(26-20)16-6-8-17(22)9-7-16/h4-11,13-14H,12H2,1-3H3,(H,25,28)