3-[[5-(methylsulfanylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(2-nitrophenyl)propanamide

Systemtic Name: 3-[[5-(methylsulfanylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(2-nitrophenyl)propanamide Openeye Name: 3-[[5-(methylsulfanylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(2-nitrophenyl)propanamide CAS Name: 3-[[5-[(methylthio)methyl]-1,3,4-oxadiazol-2-yl]thio]-N-(2-nitrophenyl)propanamide IUPAC Name: 3-[[5-(methylsulfanylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(2-nitrophenyl)propanamide Traditional Name: 3-[[5-[(methylthio)methyl]-1,3,4-oxadiazol-2-yl]thio]-N-(2-nitrophenyl)propionamide Formula: C13H14N4O4S2 MolecularWeight: 354.40466

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=NN=C(O1)SCCC(=O)NC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CSCC1=NN=C(O1)SCCC(=O)NC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O4S2/c1-22-8-12-15-16-13(21-12)23-7-6-11(18)14-9-4-2-3-5-10(9)17(19)20/h2-5H,6-8H2,1H3,(H,14,18)