S-(4-chlorophenyl) 5-(2-phenylethynyl)furan-2-carbothioate

Systemtic Name: S-(4-chlorophenyl) 5-(2-phenylethynyl)furan-2-carbothioate Openeye Name: S-(4-chlorophenyl) 5-(2-phenylethynyl)furan-2-carbothioate CAS Name: 5-(2-phenylethynyl)-2-furancarbothioic acid S-(4-chlorophenyl) ester IUPAC Name: S-(4-chlorophenyl) 5-(2-phenylethynyl)furan-2-carbothioate Traditional Name: 5-(2-phenylethynyl)furan-2-carbothioic acid S-(4-chlorophenyl) ester Formula: C19H11ClO2S MolecularWeight: 338.80744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=CC=C(O2)C(=O)SC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=CC=C(O2)C(=O)SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H11ClO2S/c20-15-7-11-17(12-8-15)23-19(21)18-13-10-16(22-18)9-6-14-4-2-1-3-5-14/h1-5,7-8,10-13H