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

Systemtic Name: 3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-5-[(4-butan-2-yloxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione Openeye Name: 3-[2-(azepan-1-yl)-2-oxo-ethyl]-5-[(4-sec-butoxyphenyl)methylene]thiazolidine-2,4-dione CAS Name: 3-[2-(1-azepanyl)-2-oxoethyl]-5-[(4-butan-2-yloxyphenyl)methylidene]thiazolidine-2,4-dione IUPAC Name: 3-[2-(azepan-1-yl)-2-oxoethyl]-5-[(4-butan-2-yloxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione Traditional Name: 3-[2-(azepan-1-yl)-2-keto-ethyl]-5-(4-sec-butoxybenzylidene)thiazolidine-2,4-quinone Formula: C22H28N2O4S MolecularWeight: 416.53372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=C(C=C1)C=C2C(=O)N(C(=O)S2)CC(=O)N3CCCCCC3

Isomeric SMILES

CCC(C)OC1=CC=C(C=C1)C=C2C(=O)N(C(=O)S2)CC(=O)N3CCCCCC3

InChI

InChI=1S/C22H28N2O4S/c1-3-16(2)28-18-10-8-17(9-11-18)14-19-21(26)24(22(27)29-19)15-20(25)23-12-6-4-5-7-13-23/h8-11,14,16H,3-7,12-13,15H2,1-2H3