4-imidazol-1-yl-5-nitro-6-phenylsulfanyl-pyrimidine

Systemtic Name: 4-imidazol-1-yl-5-nitro-6-phenylsulfanyl-pyrimidine Openeye Name: 4-imidazol-1-yl-5-nitro-6-phenylsulfanyl-pyrimidine CAS Name: 4-(1-imidazolyl)-5-nitro-6-(phenylthio)pyrimidine IUPAC Name: 4-imidazol-1-yl-5-nitro-6-phenylsulfanylpyrimidine Traditional Name: 4-imidazol-1-yl-5-nitro-6-(phenylthio)pyrimidine Formula: C13H9N5O2S MolecularWeight: 299.30786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])N3C=CN=C3

Isomeric SMILES

C1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])N3C=CN=C3

InChI

InChI=1S/C13H9N5O2S/c19-18(20)11-12(17-7-6-14-9-17)15-8-16-13(11)21-10-4-2-1-3-5-10/h1-9H