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

Systemtic Name: 2-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-N-[(4-fluorophenyl)methyl]ethanamide Openeye Name: 2-[(6,7-dimethyl-2-oxo-chromen-4-yl)methylsulfanyl]-N-[(4-fluorophenyl)methyl]acetamide CAS Name: 2-[(6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methylthio]-N-[(4-fluorophenyl)methyl]acetamide IUPAC Name: 2-[(6,7-dimethyl-2-oxochromen-4-yl)methylsulfanyl]-N-[(4-fluorophenyl)methyl]acetamide Traditional Name: N-(4-fluorobenzyl)-2-[(2-keto-6,7-dimethyl-chromen-4-yl)methylthio]acetamide Formula: C21H20FNO3S MolecularWeight: 385.451803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSCC(=O)NCC3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSCC(=O)NCC3=CC=C(C=C3)F)C

InChI

InChI=1S/C21H20FNO3S/c1-13-7-18-16(9-21(25)26-19(18)8-14(13)2)11-27-12-20(24)23-10-15-3-5-17(22)6-4-15/h3-9H,10-12H2,1-2H3,(H,23,24)