3-[2-(1,3-benzothiazol-2-yl)hydrazinyl]-1-(4-fluoranyl-3-nitro-phenyl)pyrrolidine-2,5-dione

Systemtic Name: 3-[2-(1,3-benzothiazol-2-yl)hydrazinyl]-1-(4-fluoranyl-3-nitro-phenyl)pyrrolidine-2,5-dione Openeye Name: 3-[2-(1,3-benzothiazol-2-yl)hydrazino]-1-(4-fluoro-3-nitro-phenyl)pyrrolidine-2,5-dione CAS Name: 3-(1,3-benzothiazol-2-ylhydrazo)-1-(4-fluoro-3-nitrophenyl)pyrrolidine-2,5-dione IUPAC Name: 3-[2-(1,3-benzothiazol-2-yl)hydrazinyl]-1-(4-fluoro-3-nitrophenyl)pyrrolidine-2,5-dione Traditional Name: 3-[N'-(1,3-benzothiazol-2-yl)hydrazino]-1-(4-fluoro-3-nitro-phenyl)pyrrolidine-2,5-quinone Formula: C17H12FN5O4S MolecularWeight: 401.371683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1=O)C2=CC(=C(C=C2)F)[N+](=O)[O-])NNC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1C(C(=O)N(C1=O)C2=CC(=C(C=C2)F)[N+](=O)[O-])NNC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H12FN5O4S/c18-10-6-5-9(7-13(10)23(26)27)22-15(24)8-12(16(22)25)20-21-17-19-11-3-1-2-4-14(11)28-17/h1-7,12,20H,8H2,(H,19,21)