1-[4-(phenylmethyl)piperazin-1-yl]-3-[1-(3-pyrazin-2-ylpropanoyl)piperidin-3-yl]propan-1-one

Systemtic Name: 1-[4-(phenylmethyl)piperazin-1-yl]-3-[1-(3-pyrazin-2-ylpropanoyl)piperidin-3-yl]propan-1-one Openeye Name: 1-(4-benzylpiperazin-1-yl)-3-[1-(3-pyrazin-2-ylpropanoyl)-3-piperidyl]propan-1-one CAS Name: 3-[1-[1-oxo-3-(2-pyrazinyl)propyl]-3-piperidinyl]-1-[4-(phenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-3-[1-(3-pyrazin-2-ylpropanoyl)piperidin-3-yl]propan-1-one Traditional Name: 1-(4-benzylpiperazino)-3-[1-(3-pyrazin-2-ylpropanoyl)-3-piperidyl]propan-1-one Formula: C26H35N5O2 MolecularWeight: 449.5884

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CCC2=NC=CN=C2)CCC(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CC(CN(C1)C(=O)CCC2=NC=CN=C2)CCC(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H35N5O2/c32-25(30-17-15-29(16-18-30)20-22-5-2-1-3-6-22)10-8-23-7-4-14-31(21-23)26(33)11-9-24-19-27-12-13-28-24/h1-3,5-6,12-13,19,23H,4,7-11,14-18,20-21H2