N-(8-nitro-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)benzenesulfonamide

Systemtic Name: N-(8-nitro-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)benzenesulfonamide Openeye Name: N-(8-nitro-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)benzenesulfonamide CAS Name: N-(8-nitro-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)benzenesulfonamide IUPAC Name: N-(8-nitro-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)benzenesulfonamide Traditional Name: N-(8-nitro-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)benzenesulfonamide Formula: C17H13N3O4S2 MolecularWeight: 387.43282

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=C1C=CC(=C3)[N+](=O)[O-])N=C(S2)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CC2=C(C3=C1C=CC(=C3)[N+](=O)[O-])N=C(S2)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C17H13N3O4S2/c21-20(22)12-8-6-11-7-9-15-16(14(11)10-12)18-17(25-15)19-26(23,24)13-4-2-1-3-5-13/h1-6,8,10H,7,9H2,(H,18,19)