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

Systemtic Name: 5-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonyl-2-(4-fluorophenyl)isoindole-1,3-dione Openeye Name: 5-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-2-(4-fluorophenyl)isoindoline-1,3-dione CAS Name: 5-[[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-oxomethyl]-2-(4-fluorophenyl)isoindole-1,3-dione IUPAC Name: 5-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-2-(4-fluorophenyl)isoindole-1,3-dione Traditional Name: 5-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-2-(4-fluorophenyl)isoindoline-1,3-quinone Formula: C27H20FN3O3S MolecularWeight: 485.529403

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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)C6=CC=C(C=C6)F

Isomeric SMILES

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

InChI

InChI=1S/C27H20FN3O3S/c28-18-6-8-19(9-7-18)31-26(33)20-10-5-17(15-21(20)27(31)34)25(32)30-13-11-16(12-14-30)24-29-22-3-1-2-4-23(22)35-24/h1-10,15-16H,11-14H2