2-[5-[(3-bromophenyl)methylidene]-4-oxidanylidene-3-prop-2-enyl-1,3-thiazolidin-2-ylidene]-2-cyano-N-(3-ethoxypropyl)ethanamide

Systemtic Name: 2-[5-[(3-bromophenyl)methylidene]-4-oxidanylidene-3-prop-2-enyl-1,3-thiazolidin-2-ylidene]-2-cyano-N-(3-ethoxypropyl)ethanamide Openeye Name: 2-[3-allyl-5-[(3-bromophenyl)methylene]-4-oxo-thiazolidin-2-ylidene]-2-cyano-N-(3-ethoxypropyl)acetamide CAS Name: 2-[5-[(3-bromophenyl)methylidene]-4-oxo-3-prop-2-enyl-2-thiazolidinylidene]-2-cyano-N-(3-ethoxypropyl)acetamide IUPAC Name: 2-[5-[(3-bromophenyl)methylidene]-4-oxo-3-prop-2-enyl-1,3-thiazolidin-2-ylidene]-2-cyano-N-(3-ethoxypropyl)acetamide Traditional Name: 2-[3-allyl-5-(3-bromobenzylidene)-4-keto-thiazolidin-2-ylidene]-2-cyano-N-(3-ethoxypropyl)acetamide Formula: C21H22BrN3O3S MolecularWeight: 476.38668

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)C(=C1N(C(=O)C(=CC2=CC(=CC=C2)Br)S1)CC=C)C#N

Isomeric SMILES

CCOCCCNC(=O)C(=C1N(C(=O)C(=CC2=CC(=CC=C2)Br)S1)CC=C)C#N

InChI

InChI=1S/C21H22BrN3O3S/c1-3-10-25-20(27)18(13-15-7-5-8-16(22)12-15)29-21(25)17(14-23)19(26)24-9-6-11-28-4-2/h3,5,7-8,12-13H,1,4,6,9-11H2,2H3,(H,24,26)