2-[[5-[(4-nitrophenyl)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]ethanenitrile

Systemtic Name: 2-[[5-[(4-nitrophenyl)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]ethanenitrile Openeye Name: 2-[[5-[(4-nitrophenyl)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]acetonitrile CAS Name: 2-[[5-[(4-nitrophenyl)methyl]-1,3,4-oxadiazol-2-yl]thio]acetonitrile IUPAC Name: 2-[[5-[(4-nitrophenyl)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]acetonitrile Traditional Name: 2-[[5-(4-nitrobenzyl)-1,3,4-oxadiazol-2-yl]thio]acetonitrile Formula: C11H8N4O3S MolecularWeight: 276.27122

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=NN=C(O2)SCC#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CC2=NN=C(O2)SCC#N)[N+](=O)[O-]

InChI

InChI=1S/C11H8N4O3S/c12-5-6-19-11-14-13-10(18-11)7-8-1-3-9(4-2-8)15(16)17/h1-4H,6-7H2