1-[[(2R)-2-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]-5-methyl-indole-2,3-dione

Systemtic Name: 1-[[(2R)-2-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]-5-methyl-indole-2,3-dione Openeye Name: 1-[[(2R)-2-(1,3-benzothiazol-2-yl)-1-piperidyl]methyl]-5-methyl-indoline-2,3-dione CAS Name: 1-[[(2R)-2-(1,3-benzothiazol-2-yl)-1-piperidinyl]methyl]-5-methylindole-2,3-dione IUPAC Name: 1-[[(2R)-2-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]-5-methylindole-2,3-dione Traditional Name: 1-[[(2R)-2-(1,3-benzothiazol-2-yl)piperidino]methyl]-5-methyl-isatin Formula: C22H21N3O2S MolecularWeight: 391.48604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)C2=O)CN3CCCCC3C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)C2=O)CN3CCCC[C@@H]3C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H21N3O2S/c1-14-9-10-17-15(12-14)20(26)22(27)25(17)13-24-11-5-4-7-18(24)21-23-16-6-2-3-8-19(16)28-21/h2-3,6,8-10,12,18H,4-5,7,11,13H2,1H3/t18-/m1/s1