furan-2-yl-[4-[6-[methyl(phenethyl)amino]-5-nitro-pyrimidin-4-yl]piperazin-1-yl]methanone

Systemtic Name: furan-2-yl-[4-[6-[methyl(phenethyl)amino]-5-nitro-pyrimidin-4-yl]piperazin-1-yl]methanone Openeye Name: 2-furyl-[4-[6-[methyl(phenethyl)amino]-5-nitro-pyrimidin-4-yl]piperazin-1-yl]methanone CAS Name: 2-furanyl-[4-[6-[methyl(phenethyl)amino]-5-nitro-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: furan-2-yl-[4-[6-[methyl(phenethyl)amino]-5-nitropyrimidin-4-yl]piperazin-1-yl]methanone Traditional Name: 2-furyl-[4-[6-[methyl(phenethyl)amino]-5-nitro-pyrimidin-4-yl]piperazino]methanone Formula: C22H24N6O4 MolecularWeight: 436.46376

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

CN(CCC1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C(=O)C4=CC=CO4

InChI

InChI=1S/C22H24N6O4/c1-25(10-9-17-6-3-2-4-7-17)20-19(28(30)31)21(24-16-23-20)26-11-13-27(14-12-26)22(29)18-8-5-15-32-18/h2-8,15-16H,9-14H2,1H3