[4-(2-methyl-6-morpholin-4-yl-pyrimidin-4-yl)piperazin-1-yl]-(3-nitrophenyl)methanone

Systemtic Name: [4-(2-methyl-6-morpholin-4-yl-pyrimidin-4-yl)piperazin-1-yl]-(3-nitrophenyl)methanone Openeye Name: [4-(2-methyl-6-morpholino-pyrimidin-4-yl)piperazin-1-yl]-(3-nitrophenyl)methanone CAS Name: [4-[2-methyl-6-(4-morpholinyl)-4-pyrimidinyl]-1-piperazinyl]-(3-nitrophenyl)methanone IUPAC Name: [4-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)piperazin-1-yl]-(3-nitrophenyl)methanone Traditional Name: [4-(2-methyl-6-morpholino-pyrimidin-4-yl)piperazino]-(3-nitrophenyl)methanone Formula: C20H24N6O4 MolecularWeight: 412.44236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)N2CCOCC2)N3CCN(CC3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=CC(=N1)N2CCOCC2)N3CCN(CC3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H24N6O4/c1-15-21-18(14-19(22-15)24-9-11-30-12-10-24)23-5-7-25(8-6-23)20(27)16-3-2-4-17(13-16)26(28)29/h2-4,13-14H,5-12H2,1H3