1-(1,3-benzothiazol-2-yl)-3-phenyl-pyrrolidine-2,5-dione

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-3-phenyl-pyrrolidine-2,5-dione Openeye Name: 1-(1,3-benzothiazol-2-yl)-3-phenyl-pyrrolidine-2,5-dione CAS Name: 1-(1,3-benzothiazol-2-yl)-3-phenylpyrrolidine-2,5-dione IUPAC Name: 1-(1,3-benzothiazol-2-yl)-3-phenylpyrrolidine-2,5-dione Traditional Name: 1-(1,3-benzothiazol-2-yl)-3-phenyl-pyrrolidine-2,5-quinone Formula: C17H12N2O2S MolecularWeight: 308.35438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1=O)C2=NC3=CC=CC=C3S2)C4=CC=CC=C4

Isomeric SMILES

C1C(C(=O)N(C1=O)C2=NC3=CC=CC=C3S2)C4=CC=CC=C4

InChI

InChI=1S/C17H12N2O2S/c20-15-10-12(11-6-2-1-3-7-11)16(21)19(15)17-18-13-8-4-5-9-14(13)22-17/h1-9,12H,10H2