5-[[5-(4-nitrophenyl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[[5-(4-nitrophenyl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]-1,3,4-thiadiazol-2-amine Openeye Name: 5-[[5-(4-nitrophenyl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: 5-[[5-(4-nitrophenyl)-1,2,4-oxadiazol-3-yl]methylthio]-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[[5-(4-nitrophenyl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]-1,3,4-thiadiazol-2-amine Traditional Name: [5-[[5-(4-nitrophenyl)-1,2,4-oxadiazol-3-yl]methylthio]-1,3,4-thiadiazol-2-yl]amine Formula: C11H8N6O3S2 MolecularWeight: 336.34962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=NO2)CSC3=NN=C(S3)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=NO2)CSC3=NN=C(S3)N)[N+](=O)[O-]

InChI

InChI=1S/C11H8N6O3S2/c12-10-14-15-11(22-10)21-5-8-13-9(20-16-8)6-1-3-7(4-2-6)17(18)19/h1-4H,5H2,(H2,12,14)