1-[4-(phenylmethyl)piperazin-1-yl]-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)propan-1-one

Systemtic Name: 1-[4-(phenylmethyl)piperazin-1-yl]-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)propan-1-one Openeye Name: 1-(4-benzylpiperazin-1-yl)-3-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]propan-1-one CAS Name: 1-[4-(phenylmethyl)-1-piperazinyl]-3-[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]-1-propanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)propan-1-one Traditional Name: 1-(4-benzylpiperazino)-3-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]propan-1-one Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)CCC3=NC(=NO3)C4=CN=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)CCC3=NC(=NO3)C4=CN=CC=C4

InChI

InChI=1S/C21H23N5O2/c27-20(9-8-19-23-21(24-28-19)18-7-4-10-22-15-18)26-13-11-25(12-14-26)16-17-5-2-1-3-6-17/h1-7,10,15H,8-9,11-14,16H2