1-[3-[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonylphenyl]pyrrolidine-2,5-dione

Systemtic Name: 1-[3-[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonylphenyl]pyrrolidine-2,5-dione Openeye Name: 1-[3-[(3S)-3-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]phenyl]pyrrolidine-2,5-dione CAS Name: 1-[3-[[(3S)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-oxomethyl]phenyl]pyrrolidine-2,5-dione IUPAC Name: 1-[3-[(3S)-3-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]phenyl]pyrrolidine-2,5-dione Traditional Name: 1-[3-[(3S)-3-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]phenyl]pyrrolidine-2,5-quinone Formula: C23H21N3O3S MolecularWeight: 419.49614

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC(=CC=C2)N3C(=O)CCC3=O)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)C2=CC(=CC=C2)N3C(=O)CCC3=O)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H21N3O3S/c27-20-10-11-21(28)26(20)17-7-3-5-15(13-17)23(29)25-12-4-6-16(14-25)22-24-18-8-1-2-9-19(18)30-22/h1-3,5,7-9,13,16H,4,6,10-12,14H2/t16-/m0/s1