9-ethyl-2,6-bis[(3-methyl-5-nitro-imidazol-4-yl)sulfanyl]purine

Systemtic Name: 9-ethyl-2,6-bis[(3-methyl-5-nitro-imidazol-4-yl)sulfanyl]purine Openeye Name: 9-ethyl-2,6-bis[(3-methyl-5-nitro-imidazol-4-yl)sulfanyl]purine CAS Name: 9-ethyl-2,6-bis[(3-methyl-5-nitro-4-imidazolyl)thio]purine IUPAC Name: 9-ethyl-2,6-bis[(3-methyl-5-nitroimidazol-4-yl)sulfanyl]purine Traditional Name: 9-ethyl-2,6-bis[(3-methyl-5-nitro-imidazol-4-yl)thio]purine Formula: C15H14N10O4S2 MolecularWeight: 462.46626

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1N=C(N=C2SC3=C(N=CN3C)[N+](=O)[O-])SC4=C(N=CN4C)[N+](=O)[O-]

Isomeric SMILES

CCN1C=NC2=C1N=C(N=C2SC3=C(N=CN3C)[N+](=O)[O-])SC4=C(N=CN4C)[N+](=O)[O-]

InChI

InChI=1S/C15H14N10O4S2/c1-4-23-7-16-8-9(23)19-15(31-14-11(25(28)29)18-6-22(14)3)20-12(8)30-13-10(24(26)27)17-5-21(13)2/h5-7H,4H2,1-3H3