2-[(3-nitrophenyl)methylsulfanyl]-5-propyl-1,3,4-oxadiazole

Systemtic Name: 2-[(3-nitrophenyl)methylsulfanyl]-5-propyl-1,3,4-oxadiazole Openeye Name: 2-[(3-nitrophenyl)methylsulfanyl]-5-propyl-1,3,4-oxadiazole CAS Name: 2-[(3-nitrophenyl)methylthio]-5-propyl-1,3,4-oxadiazole IUPAC Name: 2-[(3-nitrophenyl)methylsulfanyl]-5-propyl-1,3,4-oxadiazole Traditional Name: 2-[(3-nitrobenzyl)thio]-5-propyl-1,3,4-oxadiazole Formula: C12H13N3O3S MolecularWeight: 279.31492

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(O1)SCC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCC1=NN=C(O1)SCC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H13N3O3S/c1-2-4-11-13-14-12(18-11)19-8-9-5-3-6-10(7-9)15(16)17/h3,5-7H,2,4,8H2,1H3