2-[3-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-oxidanylidene-propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-oxidanylidene-propyl]isoindole-1,3-dione Openeye Name: 2-[3-[4-(1,3-benzothiazol-2-yl)-1-piperidyl]-3-oxo-propyl]isoindoline-1,3-dione CAS Name: 2-[3-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-3-oxopropyl]isoindole-1,3-dione IUPAC Name: 2-[3-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-oxopropyl]isoindole-1,3-dione Traditional Name: 2-[3-[4-(1,3-benzothiazol-2-yl)piperidino]-3-keto-propyl]isoindoline-1,3-quinone Formula: C23H21N3O3S MolecularWeight: 419.49614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)CCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)CCN4C(=O)C5=CC=CC=C5C4=O

InChI

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