2-[(7-bromanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-N-[(1S)-1-(4-fluorophenyl)ethyl]ethanamide

Systemtic Name: 2-[(7-bromanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-N-[(1S)-1-(4-fluorophenyl)ethyl]ethanamide Openeye Name: 2-[(7-bromo-2-oxo-chromen-4-yl)methylsulfanyl]-N-[(1S)-1-(4-fluorophenyl)ethyl]acetamide CAS Name: 2-[(7-bromo-2-oxo-1-benzopyran-4-yl)methylthio]-N-[(1S)-1-(4-fluorophenyl)ethyl]acetamide IUPAC Name: 2-[(7-bromo-2-oxochromen-4-yl)methylsulfanyl]-N-[(1S)-1-(4-fluorophenyl)ethyl]acetamide Traditional Name: 2-[(7-bromo-2-keto-chromen-4-yl)methylthio]-N-[(1S)-1-(4-fluorophenyl)ethyl]acetamide Formula: C20H17BrFNO3S MolecularWeight: 450.321283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)F)NC(=O)CSCC2=CC(=O)OC3=C2C=CC(=C3)Br

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)F)NC(=O)CSCC2=CC(=O)OC3=C2C=CC(=C3)Br

InChI

InChI=1S/C20H17BrFNO3S/c1-12(13-2-5-16(22)6-3-13)23-19(24)11-27-10-14-8-20(25)26-18-9-15(21)4-7-17(14)18/h2-9,12H,10-11H2,1H3,(H,23,24)/t12-/m0/s1