furan-2-yl-[4-[5-nitro-6-(2-pyridin-3-ylethylamino)pyrimidin-4-yl]piperazin-1-yl]methanone

Systemtic Name: furan-2-yl-[4-[5-nitro-6-(2-pyridin-3-ylethylamino)pyrimidin-4-yl]piperazin-1-yl]methanone Openeye Name: 2-furyl-[4-[5-nitro-6-[2-(3-pyridyl)ethylamino]pyrimidin-4-yl]piperazin-1-yl]methanone CAS Name: 2-furanyl-[4-[5-nitro-6-[2-(3-pyridinyl)ethylamino]-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: furan-2-yl-[4-[5-nitro-6-(2-pyridin-3-ylethylamino)pyrimidin-4-yl]piperazin-1-yl]methanone Traditional Name: 2-furyl-[4-[5-nitro-6-[2-(3-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=CN=CC=C3)[N+](=O)[O-])C(=O)C4=CC=CO4

Isomeric SMILES

C1CN(CCN1C2=C(C(=NC=N2)NCCC3=CN=CC=C3)[N+](=O)[O-])C(=O)C4=CC=CO4

InChI

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