7-ethyl-4-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanylmethyl]chromen-2-one

Systemtic Name: 7-ethyl-4-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanylmethyl]chromen-2-one Openeye Name: 7-ethyl-4-[(3-fluoro-4-methoxy-phenyl)methylsulfanylmethyl]chromen-2-one CAS Name: 7-ethyl-4-[[(3-fluoro-4-methoxyphenyl)methylthio]methyl]-1-benzopyran-2-one IUPAC Name: 7-ethyl-4-[(3-fluoro-4-methoxyphenyl)methylsulfanylmethyl]chromen-2-one Traditional Name: 7-ethyl-4-[[(3-fluoro-4-methoxy-benzyl)thio]methyl]coumarin Formula: C20H19FO3S MolecularWeight: 358.426463

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSCC3=CC(=C(C=C3)OC)F

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSCC3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C20H19FO3S/c1-3-13-4-6-16-15(10-20(22)24-19(16)9-13)12-25-11-14-5-7-18(23-2)17(21)8-14/h4-10H,3,11-12H2,1-2H3