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

Systemtic Name: 3-(2-chloranyl-4-nitro-phenyl)sulfanyl-5-methyl-4-phenyl-1,2,4-triazole Openeye Name: 3-(2-chloro-4-nitro-phenyl)sulfanyl-5-methyl-4-phenyl-1,2,4-triazole CAS Name: 3-[(2-chloro-4-nitrophenyl)thio]-5-methyl-4-phenyl-1,2,4-triazole IUPAC Name: 3-(2-chloro-4-nitrophenyl)sulfanyl-5-methyl-4-phenyl-1,2,4-triazole Traditional Name: 3-[(2-chloro-4-nitro-phenyl)thio]-5-methyl-4-phenyl-1,2,4-triazole Formula: C15H11ClN4O2S MolecularWeight: 346.79144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC=CC=C2)SC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=NN=C(N1C2=CC=CC=C2)SC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

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