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

Systemtic Name: 3-(2-chlorophenyl)-5-methyl-N-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]-1,2-oxazole-4-carboxamide Openeye Name: 3-(2-chlorophenyl)-5-methyl-N-[(1-pyrimidin-2-yl-3-piperidyl)methyl]isoxazole-4-carboxamide CAS Name: 3-(2-chlorophenyl)-5-methyl-N-[[1-(2-pyrimidinyl)-3-piperidinyl]methyl]-4-isoxazolecarboxamide IUPAC Name: 3-(2-chlorophenyl)-5-methyl-N-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]-1,2-oxazole-4-carboxamide Traditional Name: 3-(2-chlorophenyl)-5-methyl-N-[[1-(2-pyrimidyl)-3-piperidyl]methyl]isoxazole-4-carboxamide Formula: C21H22ClN5O2 MolecularWeight: 411.88468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NCC3CCCN(C3)C4=NC=CC=N4

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NCC3CCCN(C3)C4=NC=CC=N4

InChI

InChI=1S/C21H22ClN5O2/c1-14-18(19(26-29-14)16-7-2-3-8-17(16)22)20(28)25-12-15-6-4-11-27(13-15)21-23-9-5-10-24-21/h2-3,5,7-10,15H,4,6,11-13H2,1H3,(H,25,28)