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

Systemtic Name: 3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-5-[(2-phenylsulfanylphenyl)methylidene]-1,3-thiazolidine-2,4-dione Openeye Name: 3-[2-(azepan-1-yl)-2-oxo-ethyl]-5-[(2-phenylsulfanylphenyl)methylene]thiazolidine-2,4-dione CAS Name: 3-[2-(1-azepanyl)-2-oxoethyl]-5-[[2-(phenylthio)phenyl]methylidene]thiazolidine-2,4-dione IUPAC Name: 3-[2-(azepan-1-yl)-2-oxoethyl]-5-[(2-phenylsulfanylphenyl)methylidene]-1,3-thiazolidine-2,4-dione Traditional Name: 3-[2-(azepan-1-yl)-2-keto-ethyl]-5-[2-(phenylthio)benzylidene]thiazolidine-2,4-quinone Formula: C24H24N2O3S2 MolecularWeight: 452.58896

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2C(=O)C(=CC3=CC=CC=C3SC4=CC=CC=C4)SC2=O

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2C(=O)C(=CC3=CC=CC=C3SC4=CC=CC=C4)SC2=O

InChI

InChI=1S/C24H24N2O3S2/c27-22(25-14-8-1-2-9-15-25)17-26-23(28)21(31-24(26)29)16-18-10-6-7-13-20(18)30-19-11-4-3-5-12-19/h3-7,10-13,16H,1-2,8-9,14-15,17H2