4-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N1,N3-bis(oxidanyl)benzene-1,3-diamine oxide

Systemtic Name: 4-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N1,N3-bis(oxidanyl)benzene-1,3-diamine oxide Openeye Name: N1,N3-dihydroxy-4-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]benzene-1,3-diamine oxide CAS Name: N1,N3-dihydroxy-4-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]benzene-1,3-diamine oxide IUPAC Name: 1-N,3-N-dihydroxy-4-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]benzene-1,3-diamine oxide Traditional Name: N,N'-dihydroxy-4-[(4-keto-6-methyl-1H-pyrimidin-2-yl)thio]benzene-1,3-diamine oxide Formula: C11H12N4O5S MolecularWeight: 312.30178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SC2=C(C=C(C=C2)[NH+](O)[O-])[NH+](O)[O-]

Isomeric SMILES

CC1=CC(=O)N=C(N1)SC2=C(C=C(C=C2)[NH+](O)[O-])[NH+](O)[O-]

InChI

InChI=1S/C11H12N4O5S/c1-6-4-10(16)13-11(12-6)21-9-3-2-7(14(17)18)5-8(9)15(19)20/h2-5,14-15,17,19H,1H3,(H,12,13,16)