4-[[3,4-bis(fluoranyl)phenyl]sulfanylmethyl]-6-chloranyl-7-methyl-chromen-2-one

Systemtic Name: 4-[[3,4-bis(fluoranyl)phenyl]sulfanylmethyl]-6-chloranyl-7-methyl-chromen-2-one Openeye Name: 6-chloro-4-[(3,4-difluorophenyl)sulfanylmethyl]-7-methyl-chromen-2-one CAS Name: 6-chloro-4-[[(3,4-difluorophenyl)thio]methyl]-7-methyl-1-benzopyran-2-one IUPAC Name: 6-chloro-4-[(3,4-difluorophenyl)sulfanylmethyl]-7-methylchromen-2-one Traditional Name: 6-chloro-4-[[(3,4-difluorophenyl)thio]methyl]-7-methyl-coumarin Formula: C17H11ClF2O2S MolecularWeight: 352.782846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=CC(=C(C=C3)F)F)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC3=CC(=C(C=C3)F)F)Cl

InChI

InChI=1S/C17H11ClF2O2S/c1-9-4-16-12(7-13(9)18)10(5-17(21)22-16)8-23-11-2-3-14(19)15(20)6-11/h2-7H,8H2,1H3