3-(3-chlorophenyl)-5-[(3-nitrophenyl)methylsulfanylmethyl]-1,2,4-oxadiazole

Systemtic Name: 3-(3-chlorophenyl)-5-[(3-nitrophenyl)methylsulfanylmethyl]-1,2,4-oxadiazole Openeye Name: 3-(3-chlorophenyl)-5-[(3-nitrophenyl)methylsulfanylmethyl]-1,2,4-oxadiazole CAS Name: 3-(3-chlorophenyl)-5-[[(3-nitrophenyl)methylthio]methyl]-1,2,4-oxadiazole IUPAC Name: 3-(3-chlorophenyl)-5-[(3-nitrophenyl)methylsulfanylmethyl]-1,2,4-oxadiazole Traditional Name: 3-(3-chlorophenyl)-5-[[(3-nitrobenzyl)thio]methyl]-1,2,4-oxadiazole Formula: C16H12ClN3O3S MolecularWeight: 361.80278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CSCC2=NC(=NO2)C3=CC(=CC=C3)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CSCC2=NC(=NO2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C16H12ClN3O3S/c17-13-5-2-4-12(8-13)16-18-15(23-19-16)10-24-9-11-3-1-6-14(7-11)20(21)22/h1-8H,9-10H2