4-[2-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)ethoxy]benzenecarbonitrile

Systemtic Name: 4-[2-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)ethoxy]benzenecarbonitrile Openeye Name: 4-[2-(4-oxothieno[2,3-d]pyrimidin-3-yl)ethoxy]benzonitrile CAS Name: 4-[2-(4-oxo-3-thieno[2,3-d]pyrimidinyl)ethoxy]benzonitrile IUPAC Name: 4-[2-(4-oxothieno[2,3-d]pyrimidin-3-yl)ethoxy]benzonitrile Traditional Name: 4-[2-(4-ketothieno[2,3-d]pyrimidin-3-yl)ethoxy]benzonitrile Formula: C15H11N3O2S MolecularWeight: 297.33174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)OCCN2C=NC3=C(C2=O)C=CS3

Isomeric SMILES

C1=CC(=CC=C1C#N)OCCN2C=NC3=C(C2=O)C=CS3

InChI

InChI=1S/C15H11N3O2S/c16-9-11-1-3-12(4-2-11)20-7-6-18-10-17-14-13(15(18)19)5-8-21-14/h1-5,8,10H,6-7H2