3-(1,3-benzothiazol-2-ylsulfanyl)-1-(3-nitrophenyl)pyrrolidine-2,5-dione

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-1-(3-nitrophenyl)pyrrolidine-2,5-dione Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-1-(3-nitrophenyl)pyrrolidine-2,5-dione CAS Name: 3-(1,3-benzothiazol-2-ylthio)-1-(3-nitrophenyl)pyrrolidine-2,5-dione IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-1-(3-nitrophenyl)pyrrolidine-2,5-dione Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-1-(3-nitrophenyl)pyrrolidine-2,5-quinone Formula: C17H11N3O4S2 MolecularWeight: 385.41694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1=O)C2=CC(=CC=C2)[N+](=O)[O-])SC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1C(C(=O)N(C1=O)C2=CC(=CC=C2)[N+](=O)[O-])SC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H11N3O4S2/c21-15-9-14(26-17-18-12-6-1-2-7-13(12)25-17)16(22)19(15)10-4-3-5-11(8-10)20(23)24/h1-8,14H,9H2