2-[(1-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]-1,3-benzoxazole

Systemtic Name: 2-[(1-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]-1,3-benzoxazole Openeye Name: 2-[(1-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]-1,3-benzoxazole CAS Name: 2-[(1-methyl-5-nitro-1,2,4-triazol-3-yl)thio]-1,3-benzoxazole IUPAC Name: 2-[(1-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]-1,3-benzoxazole Traditional Name: 2-[(1-methyl-5-nitro-1,2,4-triazol-3-yl)thio]-1,3-benzoxazole Formula: C10H7N5O3S MolecularWeight: 277.25928

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(=N1)SC2=NC3=CC=CC=C3O2)[N+](=O)[O-]

Isomeric SMILES

CN1C(=NC(=N1)SC2=NC3=CC=CC=C3O2)[N+](=O)[O-]

InChI

InChI=1S/C10H7N5O3S/c1-14-9(15(16)17)12-8(13-14)19-10-11-6-4-2-3-5-7(6)18-10/h2-5H,1H3