1-[3-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonylphenyl]pyrrolidine-2,5-dione

Systemtic Name: 1-[3-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonylphenyl]pyrrolidine-2,5-dione Openeye Name: 1-[3-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]phenyl]pyrrolidine-2,5-dione CAS Name: 1-[3-[[4-(6-nitro-1,3-benzothiazol-2-yl)-1-piperazinyl]-oxomethyl]phenyl]pyrrolidine-2,5-dione IUPAC Name: 1-[3-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]phenyl]pyrrolidine-2,5-dione Traditional Name: 1-[3-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]phenyl]pyrrolidine-2,5-quinone Formula: C22H19N5O5S MolecularWeight: 465.48176

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1=O)C2=CC=CC(=C2)C(=O)N3CCN(CC3)C4=NC5=C(S4)C=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CC(=O)N(C1=O)C2=CC=CC(=C2)C(=O)N3CCN(CC3)C4=NC5=C(S4)C=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C22H19N5O5S/c28-19-6-7-20(29)26(19)15-3-1-2-14(12-15)21(30)24-8-10-25(11-9-24)22-23-17-5-4-16(27(31)32)13-18(17)33-22/h1-5,12-13H,6-11H2