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

Systemtic Name: N,2-bis(4-chloranyl-2-nitro-phenyl)-5-methylsulfanyl-1,2,4-triazol-3-amine Openeye Name: N,2-bis(4-chloro-2-nitro-phenyl)-5-methylsulfanyl-1,2,4-triazol-3-amine CAS Name: N,2-bis(4-chloro-2-nitrophenyl)-5-(methylthio)-1,2,4-triazol-3-amine IUPAC Name: N,2-bis(4-chloro-2-nitrophenyl)-5-methylsulfanyl-1,2,4-triazol-3-amine Traditional Name: (4-chloro-2-nitro-phenyl)-[2-(4-chloro-2-nitro-phenyl)-5-(methylthio)-1,2,4-triazol-3-yl]amine Formula: C15H10Cl2N6O4S MolecularWeight: 441.2487

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN(C(=N1)NC2=C(C=C(C=C2)Cl)[N+](=O)[O-])C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CSC1=NN(C(=N1)NC2=C(C=C(C=C2)Cl)[N+](=O)[O-])C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H10Cl2N6O4S/c1-28-15-19-14(18-10-4-2-8(16)6-12(10)22(24)25)21(20-15)11-5-3-9(17)7-13(11)23(26)27/h2-7H,1H3,(H,18,19,20)