2-[3-(1,3-benzodioxol-5-ylmethyl)-5-[[4-[bis(fluoranyl)methoxy]phenyl]methylidene]-4-oxidanylidene-1,3-thiazolidin-2-ylidene]-3-oxidanylidene-3-phenyl-propanenitrile

Systemtic Name: 2-[3-(1,3-benzodioxol-5-ylmethyl)-5-[[4-[bis(fluoranyl)methoxy]phenyl]methylidene]-4-oxidanylidene-1,3-thiazolidin-2-ylidene]-3-oxidanylidene-3-phenyl-propanenitrile Openeye Name: 2-[3-(1,3-benzodioxol-5-ylmethyl)-5-[[4-(difluoromethoxy)phenyl]methylene]-4-oxo-thiazolidin-2-ylidene]-3-oxo-3-phenyl-propanenitrile CAS Name: 2-[3-(1,3-benzodioxol-5-ylmethyl)-5-[[4-(difluoromethoxy)phenyl]methylidene]-4-oxo-2-thiazolidinylidene]-3-oxo-3-phenylpropanenitrile IUPAC Name: 2-[3-(1,3-benzodioxol-5-ylmethyl)-5-[[4-(difluoromethoxy)phenyl]methylidene]-4-oxo-1,3-thiazolidin-2-ylidene]-3-oxo-3-phenylpropanenitrile Traditional Name: 2-[5-[4-(difluoromethoxy)benzylidene]-4-keto-3-piperonyl-thiazolidin-2-ylidene]-3-keto-3-phenyl-propionitrile Formula: C28H18F2N2O5S MolecularWeight: 532.514726

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN3C(=O)C(=CC4=CC=C(C=C4)OC(F)F)SC3=C(C#N)C(=O)C5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN3C(=O)C(=CC4=CC=C(C=C4)OC(F)F)SC3=C(C#N)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H18F2N2O5S/c29-28(30)37-20-9-6-17(7-10-20)13-24-26(34)32(15-18-8-11-22-23(12-18)36-16-35-22)27(38-24)21(14-31)25(33)19-4-2-1-3-5-19/h1-13,28H,15-16H2