2-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]cyclohexyl]-3H-isoindol-1-one

Systemtic Name: 2-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]cyclohexyl]-3H-isoindol-1-one Openeye Name: 2-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]cyclohexyl]isoindolin-1-one CAS Name: 2-[4-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]cyclohexyl]-3H-isoindol-1-one IUPAC Name: 2-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]cyclohexyl]-3H-isoindol-1-one Traditional Name: 2-[4-[4-(1,2-benzothiazol-3-yl)piperazino]cyclohexyl]isoindolin-1-one Formula: C25H28N4OS MolecularWeight: 432.58102

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N2CCN(CC2)C3=NSC4=CC=CC=C43)N5CC6=CC=CC=C6C5=O

Isomeric SMILES

C1CC(CCC1N2CCN(CC2)C3=NSC4=CC=CC=C43)N5CC6=CC=CC=C6C5=O

InChI

InChI=1S/C25H28N4OS/c30-25-21-6-2-1-5-18(21)17-29(25)20-11-9-19(10-12-20)27-13-15-28(16-14-27)24-22-7-3-4-8-23(22)31-26-24/h1-8,19-20H,9-17H2