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

Systemtic Name: N-(oxan-4-yl)-2-[[4-(phenylmethyl)piperazin-1-yl]methyl]-1,3-oxazole-4-carboxamide Openeye Name: 2-[(4-benzylpiperazin-1-yl)methyl]-N-tetrahydropyran-4-yl-oxazole-4-carboxamide CAS Name: N-(4-oxanyl)-2-[[4-(phenylmethyl)-1-piperazinyl]methyl]-4-oxazolecarboxamide IUPAC Name: 2-[(4-benzylpiperazin-1-yl)methyl]-N-(oxan-4-yl)-1,3-oxazole-4-carboxamide Traditional Name: 2-[(4-benzylpiperazino)methyl]-N-tetrahydropyran-4-yl-oxazole-4-carboxamide Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1NC(=O)C2=COC(=N2)CN3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

C1COCCC1NC(=O)C2=COC(=N2)CN3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C21H28N4O3/c26-21(22-18-6-12-27-13-7-18)19-16-28-20(23-19)15-25-10-8-24(9-11-25)14-17-4-2-1-3-5-17/h1-5,16,18H,6-15H2,(H,22,26)