2-(3,5-dinitropyridin-2-yl)sulfanylpyrimidine

Systemtic Name: 2-(3,5-dinitropyridin-2-yl)sulfanylpyrimidine Openeye Name: 2-[(3,5-dinitro-2-pyridyl)sulfanyl]pyrimidine CAS Name: 2-[(3,5-dinitro-2-pyridinyl)thio]pyrimidine IUPAC Name: 2-(3,5-dinitropyridin-2-yl)sulfanylpyrimidine Traditional Name: 2-[(3,5-dinitro-2-pyridyl)thio]pyrimidine Formula: C9H5N5O4S MolecularWeight: 279.2321

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SC2=C(C=C(C=N2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CN=C(N=C1)SC2=C(C=C(C=N2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H5N5O4S/c15-13(16)6-4-7(14(17)18)8(12-5-6)19-9-10-2-1-3-11-9/h1-5H