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

Systemtic Name: 5-chloranyl-2-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]-1,3-benzoxazole Openeye Name: 5-chloro-2-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]-1,3-benzoxazole CAS Name: 5-chloro-2-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)thio]-1,3-benzoxazole IUPAC Name: 5-chloro-2-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)sulfanyl]-1,3-benzoxazole Traditional Name: 5-chloro-2-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)thio]-1,3-benzoxazole Formula: C10H6ClN5O3S MolecularWeight: 311.70434

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(=N1)[N+](=O)[O-])SC2=NC3=C(O2)C=CC(=C3)Cl

Isomeric SMILES

CN1C(=NC(=N1)[N+](=O)[O-])SC2=NC3=C(O2)C=CC(=C3)Cl

InChI

InChI=1S/C10H6ClN5O3S/c1-15-9(13-8(14-15)16(17)18)20-10-12-6-4-5(11)2-3-7(6)19-10/h2-4H,1H3