4,6-bis[(1-methylimidazol-2-yl)sulfanyl]-5-nitro-pyrimidine

Systemtic Name: 4,6-bis[(1-methylimidazol-2-yl)sulfanyl]-5-nitro-pyrimidine Openeye Name: 4,6-bis[(1-methylimidazol-2-yl)sulfanyl]-5-nitro-pyrimidine CAS Name: 4,6-bis[(1-methyl-2-imidazolyl)thio]-5-nitropyrimidine IUPAC Name: 4,6-bis[(1-methylimidazol-2-yl)sulfanyl]-5-nitropyrimidine Traditional Name: 4,6-bis[(1-methylimidazol-2-yl)thio]-5-nitro-pyrimidine Formula: C12H11N7O2S2 MolecularWeight: 349.39144

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC2=C(C(=NC=N2)SC3=NC=CN3C)[N+](=O)[O-]

Isomeric SMILES

CN1C=CN=C1SC2=C(C(=NC=N2)SC3=NC=CN3C)[N+](=O)[O-]

InChI

InChI=1S/C12H11N7O2S2/c1-17-5-3-13-11(17)22-9-8(19(20)21)10(16-7-15-9)23-12-14-4-6-18(12)2/h3-7H,1-2H3