5-[2-(phenylazanylmethyl)pyrrolidin-1-yl]sulfonyl-1-(phenylmethyl)indole-2,3-dione

Systemtic Name: 5-[2-(phenylazanylmethyl)pyrrolidin-1-yl]sulfonyl-1-(phenylmethyl)indole-2,3-dione Openeye Name: 5-[2-(anilinomethyl)pyrrolidin-1-yl]sulfonyl-1-benzyl-indoline-2,3-dione CAS Name: 5-[[2-(anilinomethyl)-1-pyrrolidinyl]sulfonyl]-1-(phenylmethyl)indole-2,3-dione IUPAC Name: 5-[2-(anilinomethyl)pyrrolidin-1-yl]sulfonyl-1-benzylindole-2,3-dione Traditional Name: 5-[2-(anilinomethyl)pyrrolidino]sulfonyl-1-benzyl-isatin Formula: C26H25N3O4S MolecularWeight: 475.5594

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3=O)CC4=CC=CC=C4)CNC5=CC=CC=C5

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3=O)CC4=CC=CC=C4)CNC5=CC=CC=C5

InChI

InChI=1S/C26H25N3O4S/c30-25-23-16-22(13-14-24(23)28(26(25)31)18-19-8-3-1-4-9-19)34(32,33)29-15-7-12-21(29)17-27-20-10-5-2-6-11-20/h1-6,8-11,13-14,16,21,27H,7,12,15,17-18H2