4-[5-[(5-nitro-1,3-thiazol-2-yl)sulfanyl]-1,2,3,4-tetrazol-1-yl]-N-phenyl-benzenesulfonamide

Systemtic Name: 4-[5-[(5-nitro-1,3-thiazol-2-yl)sulfanyl]-1,2,3,4-tetrazol-1-yl]-N-phenyl-benzenesulfonamide Openeye Name: 4-[5-(5-nitrothiazol-2-yl)sulfanyltetrazol-1-yl]-N-phenyl-benzenesulfonamide CAS Name: 4-[5-[(5-nitro-2-thiazolyl)thio]-1-tetrazolyl]-N-phenylbenzenesulfonamide IUPAC Name: 4-[5-[(5-nitro-1,3-thiazol-2-yl)sulfanyl]tetrazol-1-yl]-N-phenylbenzenesulfonamide Traditional Name: 4-[5-[(5-nitrothiazol-2-yl)thio]tetrazol-1-yl]-N-phenyl-benzenesulfonamide Formula: C16H11N7O4S3 MolecularWeight: 461.49804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)N3C(=NN=N3)SC4=NC=C(S4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)N3C(=NN=N3)SC4=NC=C(S4)[N+](=O)[O-]

InChI

InChI=1S/C16H11N7O4S3/c24-23(25)14-10-17-16(28-14)29-15-18-20-21-22(15)12-6-8-13(9-7-12)30(26,27)19-11-4-2-1-3-5-11/h1-10,19H