4-methyl-3,5-dinitro-2-phenylsulfanyl-pyridine

Systemtic Name: 4-methyl-3,5-dinitro-2-phenylsulfanyl-pyridine Openeye Name: 4-methyl-3,5-dinitro-2-phenylsulfanyl-pyridine CAS Name: 4-methyl-3,5-dinitro-2-(phenylthio)pyridine IUPAC Name: 4-methyl-3,5-dinitro-2-phenylsulfanylpyridine Traditional Name: 4-methyl-3,5-dinitro-2-(phenylthio)pyridine Formula: C12H9N3O4S MolecularWeight: 291.28256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC=C1[N+](=O)[O-])SC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NC=C1[N+](=O)[O-])SC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H9N3O4S/c1-8-10(14(16)17)7-13-12(11(8)15(18)19)20-9-5-3-2-4-6-9/h2-7H,1H3