(E)-2-(phenylcarbonyl)-3-[4-(2-phenylethynyl)thiophen-2-yl]prop-2-enenitrile

Systemtic Name: (E)-2-(phenylcarbonyl)-3-[4-(2-phenylethynyl)thiophen-2-yl]prop-2-enenitrile Openeye Name: (E)-2-benzoyl-3-[4-(2-phenylethynyl)-2-thienyl]prop-2-enenitrile CAS Name: (E)-2-benzoyl-3-[4-(2-phenylethynyl)-2-thiophenyl]-2-propenenitrile IUPAC Name: (E)-2-benzoyl-3-[4-(2-phenylethynyl)thiophen-2-yl]prop-2-enenitrile Traditional Name: (E)-2-benzoyl-3-[4-(2-phenylethynyl)-2-thienyl]acrylonitrile Formula: C22H13NOS MolecularWeight: 339.40972

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=CSC(=C2)C=C(C#N)C(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=CSC(=C2)/C=C(\C#N)/C(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H13NOS/c23-15-20(22(24)19-9-5-2-6-10-19)14-21-13-18(16-25-21)12-11-17-7-3-1-4-8-17/h1-10,13-14,16H/b20-14+