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

Systemtic Name: 3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-5-[(2-methoxy-4-pyrrolidin-1-yl-phenyl)methylidene]-1,3-thiazolidine-2,4-dione Openeye Name: 3-[2-(azepan-1-yl)-2-oxo-ethyl]-5-[(2-methoxy-4-pyrrolidin-1-yl-phenyl)methylene]thiazolidine-2,4-dione CAS Name: 3-[2-(1-azepanyl)-2-oxoethyl]-5-[[2-methoxy-4-(1-pyrrolidinyl)phenyl]methylidene]thiazolidine-2,4-dione IUPAC Name: 3-[2-(azepan-1-yl)-2-oxoethyl]-5-[(2-methoxy-4-pyrrolidin-1-ylphenyl)methylidene]-1,3-thiazolidine-2,4-dione Traditional Name: 3-[2-(azepan-1-yl)-2-keto-ethyl]-5-(2-methoxy-4-pyrrolidino-benzylidene)thiazolidine-2,4-quinone Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)N2CCCC2)C=C3C(=O)N(C(=O)S3)CC(=O)N4CCCCCC4

Isomeric SMILES

COC1=C(C=CC(=C1)N2CCCC2)C=C3C(=O)N(C(=O)S3)CC(=O)N4CCCCCC4

InChI

InChI=1S/C23H29N3O4S/c1-30-19-15-18(24-10-6-7-11-24)9-8-17(19)14-20-22(28)26(23(29)31-20)16-21(27)25-12-4-2-3-5-13-25/h8-9,14-15H,2-7,10-13,16H2,1H3