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

Systemtic Name: 5-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonyl-2-methyl-isoindole-1,3-dione Openeye Name: 5-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-2-methyl-isoindoline-1,3-dione CAS Name: 5-[[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-oxomethyl]-2-methylisoindole-1,3-dione IUPAC Name: 5-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-2-methylisoindole-1,3-dione Traditional Name: 5-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-2-methyl-isoindoline-1,3-quinone Formula: C22H19N3O3S MolecularWeight: 405.46956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H19N3O3S/c1-24-21(27)15-7-6-14(12-16(15)22(24)28)20(26)25-10-8-13(9-11-25)19-23-17-4-2-3-5-18(17)29-19/h2-7,12-13H,8-11H2,1H3