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

Systemtic Name: 1-[4-(phenylmethyl)piperidin-1-yl]-3-[1-(3-pyrazin-2-ylpropanoyl)piperidin-4-yl]propan-1-one Openeye Name: 1-(4-benzyl-1-piperidyl)-3-[1-(3-pyrazin-2-ylpropanoyl)-4-piperidyl]propan-1-one CAS Name: 3-[1-[1-oxo-3-(2-pyrazinyl)propyl]-4-piperidinyl]-1-[4-(phenylmethyl)-1-piperidinyl]-1-propanone IUPAC Name: 1-(4-benzylpiperidin-1-yl)-3-[1-(3-pyrazin-2-ylpropanoyl)piperidin-4-yl]propan-1-one Traditional Name: 1-(4-benzylpiperidino)-3-[1-(3-pyrazin-2-ylpropanoyl)-4-piperidyl]propan-1-one Formula: C27H36N4O2 MolecularWeight: 448.60034

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCC(=O)N2CCC(CC2)CC3=CC=CC=C3)C(=O)CCC4=NC=CN=C4

Isomeric SMILES

C1CN(CCC1CCC(=O)N2CCC(CC2)CC3=CC=CC=C3)C(=O)CCC4=NC=CN=C4

InChI

InChI=1S/C27H36N4O2/c32-26(31-18-12-24(13-19-31)20-23-4-2-1-3-5-23)8-6-22-10-16-30(17-11-22)27(33)9-7-25-21-28-14-15-29-25/h1-5,14-15,21-22,24H,6-13,16-20H2