furan-2-yl-[4-[5-nitro-6-(2-pyridin-2-ylethylamino)pyrimidin-4-yl]piperazin-1-yl]methanone

Systemtic Name: furan-2-yl-[4-[5-nitro-6-(2-pyridin-2-ylethylamino)pyrimidin-4-yl]piperazin-1-yl]methanone Openeye Name: 2-furyl-[4-[5-nitro-6-[2-(2-pyridyl)ethylamino]pyrimidin-4-yl]piperazin-1-yl]methanone CAS Name: 2-furanyl-[4-[5-nitro-6-[2-(2-pyridinyl)ethylamino]-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: furan-2-yl-[4-[5-nitro-6-(2-pyridin-2-ylethylamino)pyrimidin-4-yl]piperazin-1-yl]methanone Traditional Name: 2-furyl-[4-[5-nitro-6-[2-(2-pyridyl)ethylamino]pyrimidin-4-yl]piperazino]methanone Formula: C20H21N7O4 MolecularWeight: 423.42524

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=NC=N2)NCCC3=CC=CC=N3)[N+](=O)[O-])C(=O)C4=CC=CO4

Isomeric SMILES

C1CN(CCN1C2=C(C(=NC=N2)NCCC3=CC=CC=N3)[N+](=O)[O-])C(=O)C4=CC=CO4

InChI

InChI=1S/C20H21N7O4/c28-20(16-5-3-13-31-16)26-11-9-25(10-12-26)19-17(27(29)30)18(23-14-24-19)22-8-6-15-4-1-2-7-21-15/h1-5,7,13-14H,6,8-12H2,(H,22,23,24)