3-(2-methylsulfanylphenyl)-4-phenylselanyl-isochromen-1-one

Systemtic Name: 3-(2-methylsulfanylphenyl)-4-phenylselanyl-isochromen-1-one Openeye Name: 3-(2-methylsulfanylphenyl)-4-phenylselanyl-isochromen-1-one CAS Name: 3-[2-(methylthio)phenyl]-4-(phenylseleno)-2-benzopyran-1-one IUPAC Name: 3-(2-methylsulfanylphenyl)-4-phenylselanylisochromen-1-one Traditional Name: 3-[2-(methylthio)phenyl]-4-(phenylseleno)isocoumarin Formula: C22H16O2SSe MolecularWeight: 423.38624

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C2=C(C3=CC=CC=C3C(=O)O2)[Se]C4=CC=CC=C4

Isomeric SMILES

CSC1=CC=CC=C1C2=C(C3=CC=CC=C3C(=O)O2)[Se]C4=CC=CC=C4

InChI

InChI=1S/C22H16O2SSe/c1-25-19-14-8-7-13-18(19)20-21(26-15-9-3-2-4-10-15)16-11-5-6-12-17(16)22(23)24-20/h2-14H,1H3