2-(3-nitropyridin-2-yl)sulfanyl-1,3-benzoxazole

Systemtic Name: 2-(3-nitropyridin-2-yl)sulfanyl-1,3-benzoxazole Openeye Name: 2-[(3-nitro-2-pyridyl)sulfanyl]-1,3-benzoxazole CAS Name: 2-[(3-nitro-2-pyridinyl)thio]-1,3-benzoxazole IUPAC Name: 2-(3-nitropyridin-2-yl)sulfanyl-1,3-benzoxazole Traditional Name: 2-[(3-nitro-2-pyridyl)thio]-1,3-benzoxazole Formula: C12H7N3O3S MolecularWeight: 273.26728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)SC3=C(C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)SC3=C(C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C12H7N3O3S/c16-15(17)9-5-3-7-13-11(9)19-12-14-8-4-1-2-6-10(8)18-12/h1-7H