2-(3,5-dinitropyridin-4-yl)sulfanylpyrimidine

Systemtic Name: 2-(3,5-dinitropyridin-4-yl)sulfanylpyrimidine Openeye Name: 2-[(3,5-dinitro-4-pyridyl)sulfanyl]pyrimidine CAS Name: 2-[(3,5-dinitro-4-pyridinyl)thio]pyrimidine IUPAC Name: 2-(3,5-dinitropyridin-4-yl)sulfanylpyrimidine Traditional Name: 2-[(3,5-dinitro-4-pyridyl)thio]pyrimidine Formula: C9H5N5O4S MolecularWeight: 279.2321

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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