[3-[4-[5-(furan-2-ylcarbonylamino)pyridin-2-yl]piperazin-1-yl]-2-oxidanyl-propyl] butanoate

Systemtic Name: [3-[4-[5-(furan-2-ylcarbonylamino)pyridin-2-yl]piperazin-1-yl]-2-oxidanyl-propyl] butanoate Openeye Name: [3-[4-[5-(furan-2-carbonylamino)-2-pyridyl]piperazin-1-yl]-2-hydroxy-propyl] butanoate CAS Name: butanoic acid [3-[4-[5-[[2-furanyl(oxo)methyl]amino]-2-pyridinyl]-1-piperazinyl]-2-hydroxypropyl] ester IUPAC Name: [3-[4-[5-(furan-2-carbonylamino)pyridin-2-yl]piperazin-1-yl]-2-hydroxypropyl] butanoate Traditional Name: butyric acid [3-[4-[5-(2-furoylamino)-2-pyridyl]piperazino]-2-hydroxy-propyl] ester Formula: C21H28N4O5 MolecularWeight: 416.47082

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCC(CN1CCN(CC1)C2=NC=C(C=C2)NC(=O)C3=CC=CO3)O

Isomeric SMILES

CCCC(=O)OCC(CN1CCN(CC1)C2=NC=C(C=C2)NC(=O)C3=CC=CO3)O

InChI

InChI=1S/C21H28N4O5/c1-2-4-20(27)30-15-17(26)14-24-8-10-25(11-9-24)19-7-6-16(13-22-19)23-21(28)18-5-3-12-29-18/h3,5-7,12-13,17,26H,2,4,8-11,14-15H2,1H3,(H,23,28)