4-methyl-3-[(4-nitrophenoxy)methyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-methyl-3-[(4-nitrophenoxy)methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-methyl-3-[(4-nitrophenoxy)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-methyl-3-[(4-nitrophenoxy)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-methyl-3-[(4-nitrophenoxy)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-methyl-3-[(4-nitrophenoxy)methyl]-1H-1,2,4-triazole-5-thione Formula: C10H10N4O3S MolecularWeight: 266.2764

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NNC1=S)COC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN1C(=NNC1=S)COC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C10H10N4O3S/c1-13-9(11-12-10(13)18)6-17-8-4-2-7(3-5-8)14(15)16/h2-5H,6H2,1H3,(H,12,18)