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

Systemtic Name: 3-[(4-nitrophenyl)methylsulfanyl]-1-phenyl-1,2,4-triazole Openeye Name: 3-[(4-nitrophenyl)methylsulfanyl]-1-phenyl-1,2,4-triazole CAS Name: 3-[(4-nitrophenyl)methylthio]-1-phenyl-1,2,4-triazole IUPAC Name: 3-[(4-nitrophenyl)methylsulfanyl]-1-phenyl-1,2,4-triazole Traditional Name: 3-[(4-nitrobenzyl)thio]-1-phenyl-1,2,4-triazole Formula: C15H12N4O2S MolecularWeight: 312.34638

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=NC(=N2)SCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C=NC(=N2)SCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H12N4O2S/c20-19(21)14-8-6-12(7-9-14)10-22-15-16-11-18(17-15)13-4-2-1-3-5-13/h1-9,11H,10H2