4-(3-chlorophenyl)-3-(5-methyl-2-nitro-phenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(3-chlorophenyl)-3-(5-methyl-2-nitro-phenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-(3-chlorophenyl)-3-(5-methyl-2-nitro-phenyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(3-chlorophenyl)-3-(5-methyl-2-nitrophenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(3-chlorophenyl)-3-(5-methyl-2-nitrophenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-(3-chlorophenyl)-3-(5-methyl-2-nitro-phenyl)-1H-1,2,4-triazole-5-thione Formula: C15H11ClN4O2S MolecularWeight: 346.79144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[N+](=O)[O-])C2=NNC(=S)N2C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)[N+](=O)[O-])C2=NNC(=S)N2C3=CC(=CC=C3)Cl

InChI

InChI=1S/C15H11ClN4O2S/c1-9-5-6-13(20(21)22)12(7-9)14-17-18-15(23)19(14)11-4-2-3-10(16)8-11/h2-8H,1H3,(H,18,23)