(2-chloranyl-4-nitro-phenyl) 5-(1,2,3-thiadiazol-4-yl)thiophene-2-sulfonate

Systemtic Name: (2-chloranyl-4-nitro-phenyl) 5-(1,2,3-thiadiazol-4-yl)thiophene-2-sulfonate Openeye Name: (2-chloro-4-nitro-phenyl) 5-(thiadiazol-4-yl)thiophene-2-sulfonate CAS Name: 5-(4-thiadiazolyl)-2-thiophenesulfonic acid (2-chloro-4-nitrophenyl) ester IUPAC Name: (2-chloro-4-nitrophenyl) 5-(thiadiazol-4-yl)thiophene-2-sulfonate Traditional Name: 5-(thiadiazol-4-yl)thiophene-2-sulfonic acid (2-chloro-4-nitro-phenyl) ester Formula: C12H6ClN3O5S3 MolecularWeight: 403.84114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])Cl)OS(=O)(=O)C2=CC=C(S2)C3=CSN=N3

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])Cl)OS(=O)(=O)C2=CC=C(S2)C3=CSN=N3

InChI

InChI=1S/C12H6ClN3O5S3/c13-8-5-7(16(17)18)1-2-10(8)21-24(19,20)12-4-3-11(23-12)9-6-22-15-14-9/h1-6H