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

Systemtic Name: 2-[(4-methylsulfanylphenyl)methylsulfanyl]-5-(3-nitrophenyl)-1,3,4-oxadiazole Openeye Name: 2-[(4-methylsulfanylphenyl)methylsulfanyl]-5-(3-nitrophenyl)-1,3,4-oxadiazole CAS Name: 2-[[4-(methylthio)phenyl]methylthio]-5-(3-nitrophenyl)-1,3,4-oxadiazole IUPAC Name: 2-[(4-methylsulfanylphenyl)methylsulfanyl]-5-(3-nitrophenyl)-1,3,4-oxadiazole Traditional Name: 2-[[4-(methylthio)benzyl]thio]-5-(3-nitrophenyl)-1,3,4-oxadiazole Formula: C16H13N3O3S2 MolecularWeight: 359.42272

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CSC2=NN=C(O2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)CSC2=NN=C(O2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O3S2/c1-23-14-7-5-11(6-8-14)10-24-16-18-17-15(22-16)12-3-2-4-13(9-12)19(20)21/h2-9H,10H2,1H3