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

Systemtic Name: 3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-5-[(1-ethylindol-3-yl)methylidene]-1,3-thiazolidine-2,4-dione Openeye Name: 3-[2-(azepan-1-yl)-2-oxo-ethyl]-5-[(1-ethylindol-3-yl)methylene]thiazolidine-2,4-dione CAS Name: 3-[2-(1-azepanyl)-2-oxoethyl]-5-[(1-ethyl-3-indolyl)methylidene]thiazolidine-2,4-dione IUPAC Name: 3-[2-(azepan-1-yl)-2-oxoethyl]-5-[(1-ethylindol-3-yl)methylidene]-1,3-thiazolidine-2,4-dione Traditional Name: 3-[2-(azepan-1-yl)-2-keto-ethyl]-5-[(1-ethylindol-3-yl)methylene]thiazolidine-2,4-quinone Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O3S/c1-2-23-14-16(17-9-5-6-10-18(17)23)13-19-21(27)25(22(28)29-19)15-20(26)24-11-7-3-4-8-12-24/h5-6,9-10,13-14H,2-4,7-8,11-12,15H2,1H3