4-[(3-fluorophenyl)methylsulfanylmethyl]-6,7-dimethyl-chromen-2-one

Systemtic Name: 4-[(3-fluorophenyl)methylsulfanylmethyl]-6,7-dimethyl-chromen-2-one Openeye Name: 4-[(3-fluorophenyl)methylsulfanylmethyl]-6,7-dimethyl-chromen-2-one CAS Name: 4-[[(3-fluorophenyl)methylthio]methyl]-6,7-dimethyl-1-benzopyran-2-one IUPAC Name: 4-[(3-fluorophenyl)methylsulfanylmethyl]-6,7-dimethylchromen-2-one Traditional Name: 4-[[(3-fluorobenzyl)thio]methyl]-6,7-dimethyl-coumarin Formula: C19H17FO2S MolecularWeight: 328.400483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSCC3=CC(=CC=C3)F)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSCC3=CC(=CC=C3)F)C

InChI

InChI=1S/C19H17FO2S/c1-12-6-17-15(9-19(21)22-18(17)7-13(12)2)11-23-10-14-4-3-5-16(20)8-14/h3-9H,10-11H2,1-2H3