N-(6-nitro-1,3-benzothiazol-2-yl)-1-phenyl-methanesulfonamide

Systemtic Name: N-(6-nitro-1,3-benzothiazol-2-yl)-1-phenyl-methanesulfonamide Openeye Name: N-(6-nitro-1,3-benzothiazol-2-yl)-1-phenyl-methanesulfonamide CAS Name: N-(6-nitro-1,3-benzothiazol-2-yl)-1-phenylmethanesulfonamide IUPAC Name: N-(6-nitro-1,3-benzothiazol-2-yl)-1-phenylmethanesulfonamide Traditional Name: N-(6-nitro-1,3-benzothiazol-2-yl)-1-phenyl-methanesulfonamide Formula: C14H11N3O4S2 MolecularWeight: 349.38484

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H11N3O4S2/c18-17(19)11-6-7-12-13(8-11)22-14(15-12)16-23(20,21)9-10-4-2-1-3-5-10/h1-8H,9H2,(H,15,16)