5-methyl-N-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]-1,2-oxazol-3-amine

Systemtic Name: 5-methyl-N-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]-1,2-oxazol-3-amine Openeye Name: 5-methyl-N-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]isoxazol-3-amine CAS Name: 5-methyl-N-[6-(4-methyl-1-piperazinyl)-5-nitro-4-pyrimidinyl]-3-isoxazolamine IUPAC Name: 5-methyl-N-[6-(4-methylpiperazin-1-yl)-5-nitropyrimidin-4-yl]-1,2-oxazol-3-amine Traditional Name: (5-methylisoxazol-3-yl)-[6-(4-methylpiperazino)-5-nitro-pyrimidin-4-yl]amine Formula: C13H17N7O3 MolecularWeight: 319.31918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C

Isomeric SMILES

CC1=CC(=NO1)NC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C

InChI

InChI=1S/C13H17N7O3/c1-9-7-10(17-23-9)16-12-11(20(21)22)13(15-8-14-12)19-5-3-18(2)4-6-19/h7-8H,3-6H2,1-2H3,(H,14,15,16,17)