3-(2-chloranyl-4-methyl-phenyl)-5-(4-chloranyl-2-nitro-phenyl)sulfanyl-4-methyl-1,2,4-triazole

Systemtic Name: 3-(2-chloranyl-4-methyl-phenyl)-5-(4-chloranyl-2-nitro-phenyl)sulfanyl-4-methyl-1,2,4-triazole Openeye Name: 3-(2-chloro-4-methyl-phenyl)-5-(4-chloro-2-nitro-phenyl)sulfanyl-4-methyl-1,2,4-triazole CAS Name: 3-(2-chloro-4-methylphenyl)-5-[(4-chloro-2-nitrophenyl)thio]-4-methyl-1,2,4-triazole IUPAC Name: 3-(2-chloro-4-methylphenyl)-5-(4-chloro-2-nitrophenyl)sulfanyl-4-methyl-1,2,4-triazole Traditional Name: 3-(2-chloro-4-methyl-phenyl)-5-[(4-chloro-2-nitro-phenyl)thio]-4-methyl-1,2,4-triazole Formula: C16H12Cl2N4O2S MolecularWeight: 395.26308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NN=C(N2C)SC3=C(C=C(C=C3)Cl)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NN=C(N2C)SC3=C(C=C(C=C3)Cl)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H12Cl2N4O2S/c1-9-3-5-11(12(18)7-9)15-19-20-16(21(15)2)25-14-6-4-10(17)8-13(14)22(23)24/h3-8H,1-2H3