(2-piperidin-1-yl-1,3-benzothiazol-6-yl) 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethanoate

Systemtic Name: (2-piperidin-1-yl-1,3-benzothiazol-6-yl) 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethanoate Openeye Name: [2-(1-piperidyl)-1,3-benzothiazol-6-yl] 2-(1,3-dioxoisoindolin-2-yl)acetate CAS Name: 2-(1,3-dioxo-2-isoindolyl)acetic acid [2-(1-piperidinyl)-1,3-benzothiazol-6-yl] ester IUPAC Name: (2-piperidin-1-yl-1,3-benzothiazol-6-yl) 2-(1,3-dioxoisoindol-2-yl)acetate Traditional Name: 2-phthalimidoacetic acid (2-piperidino-1,3-benzothiazol-6-yl) ester Formula: C22H19N3O4S MolecularWeight: 421.46896

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC3=C(S2)C=C(C=C3)OC(=O)CN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1CCN(CC1)C2=NC3=C(S2)C=C(C=C3)OC(=O)CN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C22H19N3O4S/c26-19(13-25-20(27)15-6-2-3-7-16(15)21(25)28)29-14-8-9-17-18(12-14)30-22(23-17)24-10-4-1-5-11-24/h2-3,6-9,12H,1,4-5,10-11,13H2