4-[[2,5-bis(fluoranyl)phenyl]sulfanylmethyl]-7-ethyl-chromen-2-one

Systemtic Name: 4-[[2,5-bis(fluoranyl)phenyl]sulfanylmethyl]-7-ethyl-chromen-2-one Openeye Name: 4-[(2,5-difluorophenyl)sulfanylmethyl]-7-ethyl-chromen-2-one CAS Name: 4-[[(2,5-difluorophenyl)thio]methyl]-7-ethyl-1-benzopyran-2-one IUPAC Name: 4-[(2,5-difluorophenyl)sulfanylmethyl]-7-ethylchromen-2-one Traditional Name: 4-[[(2,5-difluorophenyl)thio]methyl]-7-ethyl-coumarin Formula: C18H14F2O2S MolecularWeight: 332.364366

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=C(C=CC(=C3)F)F

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=C(C=CC(=C3)F)F

InChI

InChI=1S/C18H14F2O2S/c1-2-11-3-5-14-12(8-18(21)22-16(14)7-11)10-23-17-9-13(19)4-6-15(17)20/h3-9H,2,10H2,1H3