(E)-3-(4-chlorophenyl)-1-[5-(2-phenylethynyl)thiophen-2-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(4-chlorophenyl)-1-[5-(2-phenylethynyl)thiophen-2-yl]prop-2-en-1-one Openeye Name: (E)-3-(4-chlorophenyl)-1-[5-(2-phenylethynyl)-2-thienyl]prop-2-en-1-one CAS Name: (E)-3-(4-chlorophenyl)-1-[5-(2-phenylethynyl)-2-thiophenyl]-2-propen-1-one IUPAC Name: (E)-3-(4-chlorophenyl)-1-[5-(2-phenylethynyl)thiophen-2-yl]prop-2-en-1-one Traditional Name: (E)-3-(4-chlorophenyl)-1-[5-(2-phenylethynyl)-2-thienyl]prop-2-en-1-one Formula: C21H13ClOS MolecularWeight: 348.84532

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=CC=C(S2)C(=O)C=CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=CC=C(S2)C(=O)/C=C/C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H13ClOS/c22-18-10-6-17(7-11-18)9-14-20(23)21-15-13-19(24-21)12-8-16-4-2-1-3-5-16/h1-7,9-11,13-15H/b14-9+