4-ethyl-3-[(3-methyl-4-nitro-phenoxy)methyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-ethyl-3-[(3-methyl-4-nitro-phenoxy)methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-ethyl-3-[(3-methyl-4-nitro-phenoxy)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-ethyl-3-[(3-methyl-4-nitrophenoxy)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-ethyl-3-[(3-methyl-4-nitrophenoxy)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-ethyl-3-[(3-methyl-4-nitro-phenoxy)methyl]-1H-1,2,4-triazole-5-thione Formula: C12H14N4O3S MolecularWeight: 294.32956

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NNC1=S)COC2=CC(=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCN1C(=NNC1=S)COC2=CC(=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C12H14N4O3S/c1-3-15-11(13-14-12(15)20)7-19-9-4-5-10(16(17)18)8(2)6-9/h4-6H,3,7H2,1-2H3,(H,14,20)