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

Systemtic Name: 2-[(4-ethylphenoxy)methyl]-5-[(4-nitrophenyl)methylsulfanyl]-1,3,4-oxadiazole Openeye Name: 2-[(4-ethylphenoxy)methyl]-5-[(4-nitrophenyl)methylsulfanyl]-1,3,4-oxadiazole CAS Name: 2-[(4-ethylphenoxy)methyl]-5-[(4-nitrophenyl)methylthio]-1,3,4-oxadiazole IUPAC Name: 2-[(4-ethylphenoxy)methyl]-5-[(4-nitrophenyl)methylsulfanyl]-1,3,4-oxadiazole Traditional Name: 2-[(4-ethylphenoxy)methyl]-5-[(4-nitrobenzyl)thio]-1,3,4-oxadiazole Formula: C18H17N3O4S MolecularWeight: 371.41028

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC2=NN=C(O2)SCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)OCC2=NN=C(O2)SCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O4S/c1-2-13-5-9-16(10-6-13)24-11-17-19-20-18(25-17)26-12-14-3-7-15(8-4-14)21(22)23/h3-10H,2,11-12H2,1H3