2-[[3-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonylphenyl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[3-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonylphenyl]methyl]isoindole-1,3-dione Openeye Name: 2-[[3-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]phenyl]methyl]isoindoline-1,3-dione CAS Name: 2-[[3-[[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-oxomethyl]phenyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[3-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]phenyl]methyl]isoindole-1,3-dione Traditional Name: 2-[3-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]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=CC(=CC=C4)CN5C(=O)C6=CC=CC=C6C5=O

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)C4=CC(=CC=C4)CN5C(=O)C6=CC=CC=C6C5=O

InChI

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