2-[2,3-bis(chloranyl)-6-nitro-phenyl]-5-methylsulfanyl-1,2,4-triazol-3-amine

Systemtic Name: 2-[2,3-bis(chloranyl)-6-nitro-phenyl]-5-methylsulfanyl-1,2,4-triazol-3-amine Openeye Name: 2-(2,3-dichloro-6-nitro-phenyl)-5-methylsulfanyl-1,2,4-triazol-3-amine CAS Name: 2-(2,3-dichloro-6-nitrophenyl)-5-(methylthio)-1,2,4-triazol-3-amine IUPAC Name: 2-(2,3-dichloro-6-nitrophenyl)-5-methylsulfanyl-1,2,4-triazol-3-amine Traditional Name: [2-(2,3-dichloro-6-nitro-phenyl)-5-(methylthio)-1,2,4-triazol-3-yl]amine Formula: C9H7Cl2N5O2S MolecularWeight: 320.15518

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN(C(=N1)N)C2=C(C=CC(=C2Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CSC1=NN(C(=N1)N)C2=C(C=CC(=C2Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C9H7Cl2N5O2S/c1-19-9-13-8(12)15(14-9)7-5(16(17)18)3-2-4(10)6(7)11/h2-3H,1H3,(H2,12,13,14)