4-[(E)-2-(4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)ethenyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-2-(4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)ethenyl]benzenecarbonitrile Openeye Name: 4-[(E)-2-(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)vinyl]benzonitrile CAS Name: 4-[(E)-2-(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)ethenyl]benzonitrile IUPAC Name: 4-[(E)-2-(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)ethenyl]benzonitrile Traditional Name: 4-[(E)-2-(4-keto-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)vinyl]benzonitrile Formula: C21H13N3OS MolecularWeight: 355.41242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)C=CC4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)/C=C/C4=CC=C(C=C4)C#N

InChI

InChI=1S/C21H13N3OS/c22-12-15-8-6-14(7-9-15)10-11-18-23-20(25)19-17(13-26-21(19)24-18)16-4-2-1-3-5-16/h1-11,13H,(H,23,24,25)/b11-10+