3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-5-[(1-prop-2-enylindol-3-yl)methylidene]-1,3-thiazolidine-2,4-dione

Systemtic Name: 3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-5-[(1-prop-2-enylindol-3-yl)methylidene]-1,3-thiazolidine-2,4-dione Openeye Name: 5-[(1-allylindol-3-yl)methylene]-3-[2-(azepan-1-yl)-2-oxo-ethyl]thiazolidine-2,4-dione CAS Name: 3-[2-(1-azepanyl)-2-oxoethyl]-5-[(1-prop-2-enyl-3-indolyl)methylidene]thiazolidine-2,4-dione IUPAC Name: 3-[2-(azepan-1-yl)-2-oxoethyl]-5-[(1-prop-2-enylindol-3-yl)methylidene]-1,3-thiazolidine-2,4-dione Traditional Name: 5-[(1-allylindol-3-yl)methylene]-3-[2-(azepan-1-yl)-2-keto-ethyl]thiazolidine-2,4-quinone Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C=C(C2=CC=CC=C21)C=C3C(=O)N(C(=O)S3)CC(=O)N4CCCCCC4

Isomeric SMILES

C=CCN1C=C(C2=CC=CC=C21)C=C3C(=O)N(C(=O)S3)CC(=O)N4CCCCCC4

InChI

InChI=1S/C23H25N3O3S/c1-2-11-25-15-17(18-9-5-6-10-19(18)25)14-20-22(28)26(23(29)30-20)16-21(27)24-12-7-3-4-8-13-24/h2,5-6,9-10,14-15H,1,3-4,7-8,11-13,16H2