N-[(E)-3-(6-fluoranyl-3H-inden-1-yl)-4-(4-methylsulfinylphenyl)but-3-en-2-yl]ethanamide

Systemtic Name: N-[(E)-3-(6-fluoranyl-3H-inden-1-yl)-4-(4-methylsulfinylphenyl)but-3-en-2-yl]ethanamide Openeye Name: N-[(E)-2-(6-fluoro-3H-inden-1-yl)-1-methyl-3-(4-methylsulfinylphenyl)allyl]acetamide CAS Name: N-[(E)-3-(6-fluoro-3H-inden-1-yl)-4-(4-methylsulfinylphenyl)but-3-en-2-yl]acetamide IUPAC Name: N-[(E)-3-(6-fluoro-3H-inden-1-yl)-4-(4-methylsulfinylphenyl)but-3-en-2-yl]acetamide Traditional Name: N-[(E)-2-(6-fluoro-3H-inden-1-yl)-1-methyl-3-(4-methylsulfinylphenyl)allyl]acetamide Formula: C22H22FNO2S MolecularWeight: 383.478983

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=CC1=CC=C(C=C1)S(=O)C)C2=CCC3=C2C=C(C=C3)F)NC(=O)C

Isomeric SMILES

CC(/C(=C/C1=CC=C(C=C1)S(=O)C)/C2=CCC3=C2C=C(C=C3)F)NC(=O)C

InChI

InChI=1S/C22H22FNO2S/c1-14(24-15(2)25)21(12-16-4-9-19(10-5-16)27(3)26)20-11-7-17-6-8-18(23)13-22(17)20/h4-6,8-14H,7H2,1-3H3,(H,24,25)/b21-12-