N-[2-(2-hydroxyethylamino)-5-nitro-phenyl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[2-(2-hydroxyethylamino)-5-nitro-phenyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[2-(2-hydroxyethylamino)-5-nitro-phenyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[2-(2-hydroxyethylamino)-5-nitrophenyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[2-(2-hydroxyethylamino)-5-nitrophenyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[2-(2-hydroxyethylamino)-5-nitro-phenyl]piazthiole-4-sulfonamide Formula: C14H13N5O5S2 MolecularWeight: 395.41352

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NSN=C2C(=C1)S(=O)(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])NCCO

Isomeric SMILES

C1=CC2=NSN=C2C(=C1)S(=O)(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])NCCO

InChI

InChI=1S/C14H13N5O5S2/c20-7-6-15-10-5-4-9(19(21)22)8-12(10)18-26(23,24)13-3-1-2-11-14(13)17-25-16-11/h1-5,8,15,18,20H,6-7H2