2-[(4-nitro-1,3-benzothiazol-5-yl)amino]ethanesulfonamide

Systemtic Name: 2-[(4-nitro-1,3-benzothiazol-5-yl)amino]ethanesulfonamide Openeye Name: 2-[(4-nitro-1,3-benzothiazol-5-yl)amino]ethanesulfonamide CAS Name: 2-[(4-nitro-1,3-benzothiazol-5-yl)amino]ethanesulfonamide IUPAC Name: 2-[(4-nitro-1,3-benzothiazol-5-yl)amino]ethanesulfonamide Traditional Name: 2-[(4-nitro-1,3-benzothiazol-5-yl)amino]ethanesulfonamide Formula: C9H10N4O4S2 MolecularWeight: 302.3301

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1NCCS(=O)(=O)N)[N+](=O)[O-])N=CS2

Isomeric SMILES

C1=CC2=C(C(=C1NCCS(=O)(=O)N)[N+](=O)[O-])N=CS2

InChI

InChI=1S/C9H10N4O4S2/c10-19(16,17)4-3-11-6-1-2-7-8(12-5-18-7)9(6)13(14)15/h1-2,5,11H,3-4H2,(H2,10,16,17)