2-tert-butyl-N-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]pyrimidine-5-carboxamide

Systemtic Name: 2-tert-butyl-N-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]pyrimidine-5-carboxamide Openeye Name: 2-tert-butyl-N-[1-[(3-fluorophenyl)methyl]-4-piperidyl]pyrimidine-5-carboxamide CAS Name: 2-tert-butyl-N-[1-[(3-fluorophenyl)methyl]-4-piperidinyl]-5-pyrimidinecarboxamide IUPAC Name: 2-tert-butyl-N-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]pyrimidine-5-carboxamide Traditional Name: 2-tert-butyl-N-[1-(3-fluorobenzyl)-4-piperidyl]pyrimidine-5-carboxamide Formula: C21H27FN4O MolecularWeight: 370.463683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC=C(C=N1)C(=O)NC2CCN(CC2)CC3=CC(=CC=C3)F

Isomeric SMILES

CC(C)(C)C1=NC=C(C=N1)C(=O)NC2CCN(CC2)CC3=CC(=CC=C3)F

InChI

InChI=1S/C21H27FN4O/c1-21(2,3)20-23-12-16(13-24-20)19(27)25-18-7-9-26(10-8-18)14-15-5-4-6-17(22)11-15/h4-6,11-13,18H,7-10,14H2,1-3H3,(H,25,27)