(5E)-5-[[1-(phenylmethyl)indol-3-yl]methylidene]-3-prop-2-ynyl-1,3-thiazolidine-2,4-dione

Systemtic Name: (5E)-5-[[1-(phenylmethyl)indol-3-yl]methylidene]-3-prop-2-ynyl-1,3-thiazolidine-2,4-dione Openeye Name: (5E)-5-[(1-benzylindol-3-yl)methylene]-3-prop-2-ynyl-thiazolidine-2,4-dione CAS Name: (5E)-5-[[1-(phenylmethyl)-3-indolyl]methylidene]-3-prop-2-ynylthiazolidine-2,4-dione IUPAC Name: (5E)-5-[(1-benzylindol-3-yl)methylidene]-3-prop-2-ynyl-1,3-thiazolidine-2,4-dione Traditional Name: (5E)-5-[(1-benzylindol-3-yl)methylene]-3-propargyl-thiazolidine-2,4-quinone Formula: C22H16N2O2S MolecularWeight: 372.43964

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C(=O)C(=CC2=CN(C3=CC=CC=C32)CC4=CC=CC=C4)SC1=O

Isomeric SMILES

C#CCN1C(=O)/C(=C\C2=CN(C3=CC=CC=C32)CC4=CC=CC=C4)/SC1=O

InChI

InChI=1S/C22H16N2O2S/c1-2-12-24-21(25)20(27-22(24)26)13-17-15-23(14-16-8-4-3-5-9-16)19-11-7-6-10-18(17)19/h1,3-11,13,15H,12,14H2/b20-13+