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

Systemtic Name: 2-[(4-fluorophenyl)methyl]-4-methyl-N-(1-pyrimidin-2-ylpiperidin-3-yl)-1,3-thiazole-5-carboxamide Openeye Name: 2-[(4-fluorophenyl)methyl]-4-methyl-N-(1-pyrimidin-2-yl-3-piperidyl)thiazole-5-carboxamide CAS Name: 2-[(4-fluorophenyl)methyl]-4-methyl-N-[1-(2-pyrimidinyl)-3-piperidinyl]-5-thiazolecarboxamide IUPAC Name: 2-[(4-fluorophenyl)methyl]-4-methyl-N-(1-pyrimidin-2-ylpiperidin-3-yl)-1,3-thiazole-5-carboxamide Traditional Name: 2-(4-fluorobenzyl)-4-methyl-N-[1-(2-pyrimidyl)-3-piperidyl]thiazole-5-carboxamide Formula: C21H22FN5OS MolecularWeight: 411.495683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)CC2=CC=C(C=C2)F)C(=O)NC3CCCN(C3)C4=NC=CC=N4

Isomeric SMILES

CC1=C(SC(=N1)CC2=CC=C(C=C2)F)C(=O)NC3CCCN(C3)C4=NC=CC=N4

InChI

InChI=1S/C21H22FN5OS/c1-14-19(29-18(25-14)12-15-5-7-16(22)8-6-15)20(28)26-17-4-2-11-27(13-17)21-23-9-3-10-24-21/h3,5-10,17H,2,4,11-13H2,1H3,(H,26,28)