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

Systemtic Name: 1-[[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]-5-chloranyl-indole-2,3-dione Openeye Name: 1-[[(3S)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]methyl]-5-chloro-indoline-2,3-dione CAS Name: 1-[[(3S)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]methyl]-5-chloroindole-2,3-dione IUPAC Name: 1-[[(3S)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]methyl]-5-chloroindole-2,3-dione Traditional Name: 1-[[(3S)-3-(1,3-benzothiazol-2-yl)piperidino]methyl]-5-chloro-isatin Formula: C21H18ClN3O2S MolecularWeight: 411.90452

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CN2C3=C(C=C(C=C3)Cl)C(=O)C2=O)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C[C@@H](CN(C1)CN2C3=C(C=C(C=C3)Cl)C(=O)C2=O)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C21H18ClN3O2S/c22-14-7-8-17-15(10-14)19(26)21(27)25(17)12-24-9-3-4-13(11-24)20-23-16-5-1-2-6-18(16)28-20/h1-2,5-8,10,13H,3-4,9,11-12H2/t13-/m0/s1