5-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonyl-2-(phenylmethyl)isoindole-1,3-dione

Systemtic Name: 5-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonyl-2-(phenylmethyl)isoindole-1,3-dione Openeye Name: 5-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-2-benzyl-isoindoline-1,3-dione CAS Name: 5-[[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-oxomethyl]-2-(phenylmethyl)isoindole-1,3-dione IUPAC Name: 5-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-2-benzylisoindole-1,3-dione Traditional Name: 5-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-2-benzyl-isoindoline-1,3-quinone Formula: C28H23N3O3S MolecularWeight: 481.56552

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)C4=CC5=C(C=C4)C(=O)N(C5=O)CC6=CC=CC=C6

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)C4=CC5=C(C=C4)C(=O)N(C5=O)CC6=CC=CC=C6

InChI

InChI=1S/C28H23N3O3S/c32-26(30-14-12-19(13-15-30)25-29-23-8-4-5-9-24(23)35-25)20-10-11-21-22(16-20)28(34)31(27(21)33)17-18-6-2-1-3-7-18/h1-11,16,19H,12-15,17H2