(2E)-4,4-dimethyl-3-oxidanylidene-2-(thiophen-3-ylmethylidene)pentanenitrile

Systemtic Name: (2E)-4,4-dimethyl-3-oxidanylidene-2-(thiophen-3-ylmethylidene)pentanenitrile Openeye Name: (2E)-4,4-dimethyl-3-oxo-2-(3-thienylmethylene)pentanenitrile CAS Name: (2E)-4,4-dimethyl-3-oxo-2-(3-thiophenylmethylidene)pentanenitrile IUPAC Name: (2E)-4,4-dimethyl-3-oxo-2-(thiophen-3-ylmethylidene)pentanenitrile Traditional Name: (E)-2-pivaloyl-3-(3-thienyl)acrylonitrile Formula: C12H13NOS MolecularWeight: 219.30272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(=CC1=CSC=C1)C#N

Isomeric SMILES

CC(C)(C)C(=O)/C(=C/C1=CSC=C1)/C#N

InChI

InChI=1S/C12H13NOS/c1-12(2,3)11(14)10(7-13)6-9-4-5-15-8-9/h4-6,8H,1-3H3/b10-6+