N-(1,3-benzodioxol-5-ylmethyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(2-pyrimidinyl)-1-piperazinyl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide Traditional Name: N-piperonyl-2-[4-(2-pyrimidyl)piperazino]acetamide Formula: C18H21N5O3 MolecularWeight: 355.39104

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NCC2=CC3=C(C=C2)OCO3)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCN1CC(=O)NCC2=CC3=C(C=C2)OCO3)C4=NC=CC=N4

InChI

InChI=1S/C18H21N5O3/c24-17(21-11-14-2-3-15-16(10-14)26-13-25-15)12-22-6-8-23(9-7-22)18-19-4-1-5-20-18/h1-5,10H,6-9,11-13H2,(H,21,24)