5-(2-phenylsulfanylethynyl)-1,3-benzodioxole

Systemtic Name: 5-(2-phenylsulfanylethynyl)-1,3-benzodioxole Openeye Name: 5-(2-phenylsulfanylethynyl)-1,3-benzodioxole CAS Name: 5-[2-(phenylthio)ethynyl]-1,3-benzodioxole IUPAC Name: 5-(2-phenylsulfanylethynyl)-1,3-benzodioxole Traditional Name: 5-[2-(phenylthio)ethynyl]-1,3-benzodioxole Formula: C15H10O2S MolecularWeight: 254.3037

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C#CSC3=CC=CC=C3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C#CSC3=CC=CC=C3

InChI

InChI=1S/C15H10O2S/c1-2-4-13(5-3-1)18-9-8-12-6-7-14-15(10-12)17-11-16-14/h1-7,10H,11H2