4-[[2-(3,3-dimethyl-2-oxidanylidene-butylidene)-4-oxidanylidene-1,3-thiazolidin-3-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[2-(3,3-dimethyl-2-oxidanylidene-butylidene)-4-oxidanylidene-1,3-thiazolidin-3-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[2-(3,3-dimethyl-2-oxo-butylidene)-4-oxo-thiazolidin-3-yl]methyl]benzonitrile CAS Name: 4-[[2-(3,3-dimethyl-2-oxobutylidene)-4-oxo-3-thiazolidinyl]methyl]benzonitrile IUPAC Name: 4-[[2-(3,3-dimethyl-2-oxobutylidene)-4-oxo-1,3-thiazolidin-3-yl]methyl]benzonitrile Traditional Name: 4-[[4-keto-2-(2-keto-3,3-dimethyl-butylidene)thiazolidin-3-yl]methyl]benzonitrile Formula: C17H18N2O2S MolecularWeight: 314.40202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C=C1N(C(=O)CS1)CC2=CC=C(C=C2)C#N

Isomeric SMILES

CC(C)(C)C(=O)C=C1N(C(=O)CS1)CC2=CC=C(C=C2)C#N

InChI

InChI=1S/C17H18N2O2S/c1-17(2,3)14(20)8-16-19(15(21)11-22-16)10-13-6-4-12(9-18)5-7-13/h4-8H,10-11H2,1-3H3