4-[(E)-[2,4-bis(oxidanylidene)-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene]methyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-[2,4-bis(oxidanylidene)-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene]methyl]benzenecarbonitrile Openeye Name: 4-[(E)-(2,4-dioxo-3-prop-2-ynyl-thiazolidin-5-ylidene)methyl]benzonitrile CAS Name: 4-[(E)-(2,4-dioxo-3-prop-2-ynyl-5-thiazolidinylidene)methyl]benzonitrile IUPAC Name: 4-[(E)-(2,4-dioxo-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene)methyl]benzonitrile Traditional Name: 4-[(E)-(2,4-diketo-3-propargyl-thiazolidin-5-ylidene)methyl]benzonitrile Formula: C14H8N2O2S MolecularWeight: 268.29052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C(=O)C(=CC2=CC=C(C=C2)C#N)SC1=O

Isomeric SMILES

C#CCN1C(=O)/C(=C\C2=CC=C(C=C2)C#N)/SC1=O

InChI

InChI=1S/C14H8N2O2S/c1-2-7-16-13(17)12(19-14(16)18)8-10-3-5-11(9-15)6-4-10/h1,3-6,8H,7H2/b12-8+