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

Systemtic Name: 3-(2-chloranyl-4-nitro-phenyl)sulfanyl-4-ethyl-5-(2-methylphenyl)-1,2,4-triazole Openeye Name: 3-(2-chloro-4-nitro-phenyl)sulfanyl-4-ethyl-5-(o-tolyl)-1,2,4-triazole CAS Name: 3-[(2-chloro-4-nitrophenyl)thio]-4-ethyl-5-(2-methylphenyl)-1,2,4-triazole IUPAC Name: 3-(2-chloro-4-nitrophenyl)sulfanyl-4-ethyl-5-(2-methylphenyl)-1,2,4-triazole Traditional Name: 3-[(2-chloro-4-nitro-phenyl)thio]-4-ethyl-5-(o-tolyl)-1,2,4-triazole Formula: C17H15ClN4O2S MolecularWeight: 374.8446

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C3=CC=CC=C3C

Isomeric SMILES

CCN1C(=NN=C1SC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C3=CC=CC=C3C

InChI

InChI=1S/C17H15ClN4O2S/c1-3-21-16(13-7-5-4-6-11(13)2)19-20-17(21)25-15-9-8-12(22(23)24)10-14(15)18/h4-10H,3H2,1-2H3