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

Systemtic Name: 3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-5-[(5-bromanyl-1H-indol-3-yl)methylidene]-1,3-thiazolidine-2,4-dione Openeye Name: 3-[2-(azepan-1-yl)-2-oxo-ethyl]-5-[(5-bromo-1H-indol-3-yl)methylene]thiazolidine-2,4-dione CAS Name: 3-[2-(1-azepanyl)-2-oxoethyl]-5-[(5-bromo-1H-indol-3-yl)methylidene]thiazolidine-2,4-dione IUPAC Name: 3-[2-(azepan-1-yl)-2-oxoethyl]-5-[(5-bromo-1H-indol-3-yl)methylidene]-1,3-thiazolidine-2,4-dione Traditional Name: 3-[2-(azepan-1-yl)-2-keto-ethyl]-5-[(5-bromo-1H-indol-3-yl)methylene]thiazolidine-2,4-quinone Formula: C20H20BrN3O3S MolecularWeight: 462.3601

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2C(=O)C(=CC3=CNC4=C3C=C(C=C4)Br)SC2=O

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2C(=O)C(=CC3=CNC4=C3C=C(C=C4)Br)SC2=O

InChI

InChI=1S/C20H20BrN3O3S/c21-14-5-6-16-15(10-14)13(11-22-16)9-17-19(26)24(20(27)28-17)12-18(25)23-7-3-1-2-4-8-23/h5-6,9-11,22H,1-4,7-8,12H2