N-(2-methylpropyl)-2-[[4-(phenylmethyl)piperazin-1-yl]methyl]-1,3-oxazole-4-carboxamide

Systemtic Name: N-(2-methylpropyl)-2-[[4-(phenylmethyl)piperazin-1-yl]methyl]-1,3-oxazole-4-carboxamide Openeye Name: 2-[(4-benzylpiperazin-1-yl)methyl]-N-isobutyl-oxazole-4-carboxamide CAS Name: N-(2-methylpropyl)-2-[[4-(phenylmethyl)-1-piperazinyl]methyl]-4-oxazolecarboxamide IUPAC Name: 2-[(4-benzylpiperazin-1-yl)methyl]-N-(2-methylpropyl)-1,3-oxazole-4-carboxamide Traditional Name: 2-[(4-benzylpiperazino)methyl]-N-isobutyl-oxazole-4-carboxamide Formula: C20H28N4O2 MolecularWeight: 356.46192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=COC(=N1)CN2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)CNC(=O)C1=COC(=N1)CN2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H28N4O2/c1-16(2)12-21-20(25)18-15-26-19(22-18)14-24-10-8-23(9-11-24)13-17-6-4-3-5-7-17/h3-7,15-16H,8-14H2,1-2H3,(H,21,25)