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

Systemtic Name: [4-[6-(cyclopropylmethylamino)-5-nitro-pyrimidin-4-yl]piperazin-1-yl]-(furan-2-yl)methanone Openeye Name: [4-[6-(cyclopropylmethylamino)-5-nitro-pyrimidin-4-yl]piperazin-1-yl]-(2-furyl)methanone CAS Name: [4-[6-(cyclopropylmethylamino)-5-nitro-4-pyrimidinyl]-1-piperazinyl]-(2-furanyl)methanone IUPAC Name: [4-[6-(cyclopropylmethylamino)-5-nitropyrimidin-4-yl]piperazin-1-yl]-(furan-2-yl)methanone Traditional Name: [4-[6-(cyclopropylmethylamino)-5-nitro-pyrimidin-4-yl]piperazino]-(2-furyl)methanone Formula: C17H20N6O4 MolecularWeight: 372.3785

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CNC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

C1CC1CNC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C(=O)C4=CC=CO4

InChI

InChI=1S/C17H20N6O4/c24-17(13-2-1-9-27-13)22-7-5-21(6-8-22)16-14(23(25)26)15(19-11-20-16)18-10-12-3-4-12/h1-2,9,11-12H,3-8,10H2,(H,18,19,20)