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

Systemtic Name: [4-[6-(3,6-dihydro-2H-pyridin-1-yl)-5-nitro-pyrimidin-4-yl]piperazin-1-yl]-(furan-2-yl)methanone Openeye Name: [4-[6-(3,6-dihydro-2H-pyridin-1-yl)-5-nitro-pyrimidin-4-yl]piperazin-1-yl]-(2-furyl)methanone CAS Name: [4-[6-(3,6-dihydro-2H-pyridin-1-yl)-5-nitro-4-pyrimidinyl]-1-piperazinyl]-(2-furanyl)methanone IUPAC Name: [4-[6-(3,6-dihydro-2H-pyridin-1-yl)-5-nitropyrimidin-4-yl]piperazin-1-yl]-(furan-2-yl)methanone Traditional Name: [4-[6-(3,6-dihydro-2H-pyridin-1-yl)-5-nitro-pyrimidin-4-yl]piperazino]-(2-furyl)methanone Formula: C18H20N6O4 MolecularWeight: 384.3892

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC=C1)C2=C(C(=NC=N2)N3CCN(CC3)C(=O)C4=CC=CO4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC=C1)C2=C(C(=NC=N2)N3CCN(CC3)C(=O)C4=CC=CO4)[N+](=O)[O-]

InChI

InChI=1S/C18H20N6O4/c25-18(14-5-4-12-28-14)23-10-8-22(9-11-23)17-15(24(26)27)16(19-13-20-17)21-6-2-1-3-7-21/h1-2,4-5,12-13H,3,6-11H2