6-(3-ethyl-2-methyl-5-nitro-imidazol-4-yl)sulfanyl-7H-purine

Systemtic Name: 6-(3-ethyl-2-methyl-5-nitro-imidazol-4-yl)sulfanyl-7H-purine Openeye Name: 6-(3-ethyl-2-methyl-5-nitro-imidazol-4-yl)sulfanyl-7H-purine CAS Name: 6-[(3-ethyl-2-methyl-5-nitro-4-imidazolyl)thio]-7H-purine IUPAC Name: 6-(3-ethyl-2-methyl-5-nitroimidazol-4-yl)sulfanyl-7H-purine Traditional Name: 6-[(3-ethyl-2-methyl-5-nitro-imidazol-4-yl)thio]-7H-purine Formula: C11H11N7O2S MolecularWeight: 305.31574

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC(=C1SC2=NC=NC3=C2NC=N3)[N+](=O)[O-])C

Isomeric SMILES

CCN1C(=NC(=C1SC2=NC=NC3=C2NC=N3)[N+](=O)[O-])C

InChI

InChI=1S/C11H11N7O2S/c1-3-17-6(2)16-9(18(19)20)11(17)21-10-7-8(13-4-12-7)14-5-15-10/h4-5H,3H2,1-2H3,(H,12,13,14,15)