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

Systemtic Name: furan-2-yl-[4-[6-(naphthalen-1-ylmethylamino)-5-nitro-pyrimidin-4-yl]piperazin-1-yl]methanone Openeye Name: 2-furyl-[4-[6-(1-naphthylmethylamino)-5-nitro-pyrimidin-4-yl]piperazin-1-yl]methanone CAS Name: 2-furanyl-[4-[6-(1-naphthalenylmethylamino)-5-nitro-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: furan-2-yl-[4-[6-(naphthalen-1-ylmethylamino)-5-nitropyrimidin-4-yl]piperazin-1-yl]methanone Traditional Name: 2-furyl-[4-[6-(1-naphthylmethylamino)-5-nitro-pyrimidin-4-yl]piperazino]methanone Formula: C24H22N6O4 MolecularWeight: 458.46928

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=NC=N2)NCC3=CC=CC4=CC=CC=C43)[N+](=O)[O-])C(=O)C5=CC=CO5

Isomeric SMILES

C1CN(CCN1C2=C(C(=NC=N2)NCC3=CC=CC4=CC=CC=C43)[N+](=O)[O-])C(=O)C5=CC=CO5

InChI

InChI=1S/C24H22N6O4/c31-24(20-9-4-14-34-20)29-12-10-28(11-13-29)23-21(30(32)33)22(26-16-27-23)25-15-18-7-3-6-17-5-1-2-8-19(17)18/h1-9,14,16H,10-13,15H2,(H,25,26,27)