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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C=NN=C2SCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)N2C=NN=C2SCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

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