3-nitro-2-[3-(3-nitropyridin-2-yl)sulfanyl-1,2,4-triazol-1-yl]pyridine

Systemtic Name: 3-nitro-2-[3-(3-nitropyridin-2-yl)sulfanyl-1,2,4-triazol-1-yl]pyridine Openeye Name: 3-nitro-2-[3-[(3-nitro-2-pyridyl)sulfanyl]-1,2,4-triazol-1-yl]pyridine CAS Name: 3-nitro-2-[3-[(3-nitro-2-pyridinyl)thio]-1,2,4-triazol-1-yl]pyridine IUPAC Name: 3-nitro-2-[3-(3-nitropyridin-2-yl)sulfanyl-1,2,4-triazol-1-yl]pyridine Traditional Name: 3-nitro-2-[3-[(3-nitro-2-pyridyl)thio]-1,2,4-triazol-1-yl]pyridine Formula: C12H7N7O4S MolecularWeight: 345.29348

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)N2C=NC(=N2)SC3=C(C=CC=N3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(N=C1)N2C=NC(=N2)SC3=C(C=CC=N3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H7N7O4S/c20-18(21)8-3-1-5-13-10(8)17-7-15-12(16-17)24-11-9(19(22)23)4-2-6-14-11/h1-7H