5-(4-methoxyphenyl)-3-[(2-nitrophenyl)methylsulfanyl]-1H-1,2,4-triazole

Systemtic Name: 5-(4-methoxyphenyl)-3-[(2-nitrophenyl)methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-(4-methoxyphenyl)-3-[(2-nitrophenyl)methylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-(4-methoxyphenyl)-3-[(2-nitrophenyl)methylthio]-1H-1,2,4-triazole IUPAC Name: 5-(4-methoxyphenyl)-3-[(2-nitrophenyl)methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-(4-methoxyphenyl)-3-[(2-nitrobenzyl)thio]-1H-1,2,4-triazole Formula: C16H14N4O3S MolecularWeight: 342.37236

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=NN2)SCC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=NN2)SCC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O3S/c1-23-13-8-6-11(7-9-13)15-17-16(19-18-15)24-10-12-4-2-3-5-14(12)20(21)22/h2-9H,10H2,1H3,(H,17,18,19)