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

Systemtic Name: 5-methyl-N-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]-1,2-oxazol-3-amine Openeye Name: 5-methyl-N-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]isoxazol-3-amine CAS Name: 5-methyl-N-[5-nitro-6-(4-phenyl-1-piperazinyl)-4-pyrimidinyl]-3-isoxazolamine IUPAC Name: 5-methyl-N-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]-1,2-oxazol-3-amine Traditional Name: (5-methylisoxazol-3-yl)-[5-nitro-6-(4-phenylpiperazino)pyrimidin-4-yl]amine Formula: C18H19N7O3 MolecularWeight: 381.38856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NO1)NC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C18H19N7O3/c1-13-11-15(22-28-13)21-17-16(25(26)27)18(20-12-19-17)24-9-7-23(8-10-24)14-5-3-2-4-6-14/h2-6,11-12H,7-10H2,1H3,(H,19,20,21,22)