N-[5-[(3-fluorophenyl)methyl]-1,3-thiazol-2-yl]-1-pyrimidin-2-yl-piperidine-4-carboxamide

Systemtic Name: N-[5-[(3-fluorophenyl)methyl]-1,3-thiazol-2-yl]-1-pyrimidin-2-yl-piperidine-4-carboxamide Openeye Name: N-[5-[(3-fluorophenyl)methyl]thiazol-2-yl]-1-pyrimidin-2-yl-piperidine-4-carboxamide CAS Name: N-[5-[(3-fluorophenyl)methyl]-2-thiazolyl]-1-(2-pyrimidinyl)-4-piperidinecarboxamide IUPAC Name: N-[5-[(3-fluorophenyl)methyl]-1,3-thiazol-2-yl]-1-pyrimidin-2-ylpiperidine-4-carboxamide Traditional Name: N-[5-(3-fluorobenzyl)thiazol-2-yl]-1-(2-pyrimidyl)isonipecotamide Formula: C20H20FN5OS MolecularWeight: 397.469103

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=NC=C(S2)CC3=CC(=CC=C3)F)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=NC=C(S2)CC3=CC(=CC=C3)F)C4=NC=CC=N4

InChI

InChI=1S/C20H20FN5OS/c21-16-4-1-3-14(11-16)12-17-13-24-20(28-17)25-18(27)15-5-9-26(10-6-15)19-22-7-2-8-23-19/h1-4,7-8,11,13,15H,5-6,9-10,12H2,(H,24,25,27)