3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-5-[(3-ethoxy-4-phenylmethoxy-5-prop-2-enyl-phenyl)methylidene]-1,3-thiazolidine-2,4-dione

Systemtic Name: 3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-5-[(3-ethoxy-4-phenylmethoxy-5-prop-2-enyl-phenyl)methylidene]-1,3-thiazolidine-2,4-dione Openeye Name: 5-[(3-allyl-4-benzyloxy-5-ethoxy-phenyl)methylene]-3-[2-(azepan-1-yl)-2-oxo-ethyl]thiazolidine-2,4-dione CAS Name: 3-[2-(1-azepanyl)-2-oxoethyl]-5-[(3-ethoxy-4-phenylmethoxy-5-prop-2-enylphenyl)methylidene]thiazolidine-2,4-dione IUPAC Name: 3-[2-(azepan-1-yl)-2-oxoethyl]-5-[(3-ethoxy-4-phenylmethoxy-5-prop-2-enylphenyl)methylidene]-1,3-thiazolidine-2,4-dione Traditional Name: 5-(3-allyl-4-benzoxy-5-ethoxy-benzylidene)-3-[2-(azepan-1-yl)-2-keto-ethyl]thiazolidine-2,4-quinone Formula: C30H34N2O5S MolecularWeight: 534.66636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC2=CC=CC=C2)CC=C)C=C3C(=O)N(C(=O)S3)CC(=O)N4CCCCCC4

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC2=CC=CC=C2)CC=C)C=C3C(=O)N(C(=O)S3)CC(=O)N4CCCCCC4

InChI

InChI=1S/C30H34N2O5S/c1-3-12-24-17-23(18-25(36-4-2)28(24)37-21-22-13-8-7-9-14-22)19-26-29(34)32(30(35)38-26)20-27(33)31-15-10-5-6-11-16-31/h3,7-9,13-14,17-19H,1,4-6,10-12,15-16,20-21H2,2H3