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

Systemtic Name: 1-[[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]methyl]-5-chloranyl-indole-2,3-dione Openeye Name: 1-[[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]methyl]-5-chloro-indoline-2,3-dione CAS Name: 1-[[(2R)-2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]methyl]-5-chloroindole-2,3-dione IUPAC Name: 1-[[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]methyl]-5-chloroindole-2,3-dione Traditional Name: 1-[[(2R)-2-(1,3-benzothiazol-2-yl)pyrrolidino]methyl]-5-chloro-isatin Formula: C20H16ClN3O2S MolecularWeight: 397.87794

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16ClN3O2S/c21-12-7-8-15-13(10-12)18(25)20(26)24(15)11-23-9-3-5-16(23)19-22-14-4-1-2-6-17(14)27-19/h1-2,4,6-8,10,16H,3,5,9,11H2/t16-/m1/s1