4-[4-[2,4-bis(azanyl)-6-methyl-pyrimidin-5-yl]piperazin-1-yl]-N-oxidanyl-benzeneamine oxide

Systemtic Name: 4-[4-[2,4-bis(azanyl)-6-methyl-pyrimidin-5-yl]piperazin-1-yl]-N-oxidanyl-benzeneamine oxide Openeye Name: 4-[4-(2,4-diamino-6-methyl-pyrimidin-5-yl)piperazin-1-yl]-N-hydroxy-benzeneamine oxide CAS Name: 4-[4-(2,4-diamino-6-methyl-5-pyrimidinyl)-1-piperazinyl]-N-hydroxybenzeneamine oxide IUPAC Name: 4-[4-(2,4-diamino-6-methylpyrimidin-5-yl)piperazin-1-yl]-N-hydroxybenzeneamine oxide Traditional Name: 4-[4-(2,4-diamino-6-methyl-pyrimidin-5-yl)piperazino]-N-hydroxy-benzeneamine oxide Formula: C15H21N7O2 MolecularWeight: 331.37294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)N)N)N2CCN(CC2)C3=CC=C(C=C3)[NH+](O)[O-]

Isomeric SMILES

CC1=C(C(=NC(=N1)N)N)N2CCN(CC2)C3=CC=C(C=C3)[NH+](O)[O-]

InChI

InChI=1S/C15H21N7O2/c1-10-13(14(16)19-15(17)18-10)21-8-6-20(7-9-21)11-2-4-12(5-3-11)22(23)24/h2-5,22-23H,6-9H2,1H3,(H4,16,17,18,19)