N-[(1-methylpyrazol-4-yl)methyl]-5-[[4-(phenylmethyl)piperidin-1-yl]methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-[(1-methylpyrazol-4-yl)methyl]-5-[[4-(phenylmethyl)piperidin-1-yl]methyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-[(4-benzyl-1-piperidyl)methyl]-N-[(1-methylpyrazol-4-yl)methyl]isoxazole-3-carboxamide CAS Name: N-[(1-methyl-4-pyrazolyl)methyl]-5-[[4-(phenylmethyl)-1-piperidinyl]methyl]-3-isoxazolecarboxamide IUPAC Name: 5-[(4-benzylpiperidin-1-yl)methyl]-N-[(1-methylpyrazol-4-yl)methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[(4-benzylpiperidino)methyl]-N-[(1-methylpyrazol-4-yl)methyl]isoxazole-3-carboxamide Formula: C22H27N5O2 MolecularWeight: 393.48208

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CNC(=O)C2=NOC(=C2)CN3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

CN1C=C(C=N1)CNC(=O)C2=NOC(=C2)CN3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H27N5O2/c1-26-15-19(14-24-26)13-23-22(28)21-12-20(29-25-21)16-27-9-7-18(8-10-27)11-17-5-3-2-4-6-17/h2-6,12,14-15,18H,7-11,13,16H2,1H3,(H,23,28)