N-methyl-4-nitro-N-[2,4,6-tris(azanyl)pyrimidin-5-yl]benzenesulfonamide

Systemtic Name: N-methyl-4-nitro-N-[2,4,6-tris(azanyl)pyrimidin-5-yl]benzenesulfonamide Openeye Name: N-methyl-4-nitro-N-(2,4,6-triaminopyrimidin-5-yl)benzenesulfonamide CAS Name: N-methyl-4-nitro-N-(2,4,6-triamino-5-pyrimidinyl)benzenesulfonamide IUPAC Name: N-methyl-4-nitro-N-(2,4,6-triaminopyrimidin-5-yl)benzenesulfonamide Traditional Name: N-methyl-4-nitro-N-(2,4,6-triaminopyrimidin-5-yl)benzenesulfonamide Formula: C11H13N7O4S MolecularWeight: 339.33042

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=C(N=C(N=C1N)N)N)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN(C1=C(N=C(N=C1N)N)N)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H13N7O4S/c1-17(8-9(12)15-11(14)16-10(8)13)23(21,22)7-4-2-6(3-5-7)18(19)20/h2-5H,1H3,(H6,12,13,14,15,16)