2-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-N-[2-(4-fluorophenyl)ethyl]ethanamide

Systemtic Name: 2-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-N-[2-(4-fluorophenyl)ethyl]ethanamide Openeye Name: 2-[(6,7-dimethyl-2-oxo-chromen-4-yl)methylsulfanyl]-N-[2-(4-fluorophenyl)ethyl]acetamide CAS Name: 2-[(6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methylthio]-N-[2-(4-fluorophenyl)ethyl]acetamide IUPAC Name: 2-[(6,7-dimethyl-2-oxochromen-4-yl)methylsulfanyl]-N-[2-(4-fluorophenyl)ethyl]acetamide Traditional Name: N-[2-(4-fluorophenyl)ethyl]-2-[(2-keto-6,7-dimethyl-chromen-4-yl)methylthio]acetamide Formula: C22H22FNO3S MolecularWeight: 399.478383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSCC(=O)NCCC3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSCC(=O)NCCC3=CC=C(C=C3)F)C

InChI

InChI=1S/C22H22FNO3S/c1-14-9-19-17(11-22(26)27-20(19)10-15(14)2)12-28-13-21(25)24-8-7-16-3-5-18(23)6-4-16/h3-6,9-11H,7-8,12-13H2,1-2H3,(H,24,25)