2-propan-2-yl-N-[[(3R)-1-pyrimidin-2-ylpiperidin-3-yl]methyl]-1,3-benzoxazole-5-carboxamide

Systemtic Name: 2-propan-2-yl-N-[[(3R)-1-pyrimidin-2-ylpiperidin-3-yl]methyl]-1,3-benzoxazole-5-carboxamide Openeye Name: 2-isopropyl-N-[[(3R)-1-pyrimidin-2-yl-3-piperidyl]methyl]-1,3-benzoxazole-5-carboxamide CAS Name: 2-propan-2-yl-N-[[(3R)-1-(2-pyrimidinyl)-3-piperidinyl]methyl]-1,3-benzoxazole-5-carboxamide IUPAC Name: 2-propan-2-yl-N-[[(3R)-1-pyrimidin-2-ylpiperidin-3-yl]methyl]-1,3-benzoxazole-5-carboxamide Traditional Name: 2-isopropyl-N-[[(3R)-1-(2-pyrimidyl)-3-piperidyl]methyl]-1,3-benzoxazole-5-carboxamide Formula: C21H25N5O2 MolecularWeight: 379.4555

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(O1)C=CC(=C2)C(=O)NCC3CCCN(C3)C4=NC=CC=N4

Isomeric SMILES

CC(C)C1=NC2=C(O1)C=CC(=C2)C(=O)NC[C@H]3CCCN(C3)C4=NC=CC=N4

InChI

InChI=1S/C21H25N5O2/c1-14(2)20-25-17-11-16(6-7-18(17)28-20)19(27)24-12-15-5-3-10-26(13-15)21-22-8-4-9-23-21/h4,6-9,11,14-15H,3,5,10,12-13H2,1-2H3,(H,24,27)/t15-/m1/s1