2-(2-ethylsulfanylethylsulfanyl)-5-(3-nitrophenyl)-1,3,4-thiadiazole

Systemtic Name: 2-(2-ethylsulfanylethylsulfanyl)-5-(3-nitrophenyl)-1,3,4-thiadiazole Openeye Name: 2-(2-ethylsulfanylethylsulfanyl)-5-(3-nitrophenyl)-1,3,4-thiadiazole CAS Name: 2-[2-(ethylthio)ethylthio]-5-(3-nitrophenyl)-1,3,4-thiadiazole IUPAC Name: 2-(2-ethylsulfanylethylsulfanyl)-5-(3-nitrophenyl)-1,3,4-thiadiazole Traditional Name: 2-[2-(ethylthio)ethylthio]-5-(3-nitrophenyl)-1,3,4-thiadiazole Formula: C12H13N3O2S3 MolecularWeight: 327.44552

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Descriptors Computed from Structure

Canonical SMILES:

CCSCCSC1=NN=C(S1)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCSCCSC1=NN=C(S1)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H13N3O2S3/c1-2-18-6-7-19-12-14-13-11(20-12)9-4-3-5-10(8-9)15(16)17/h3-5,8H,2,6-7H2,1H3