(E)-3-(dimethylamino)-1-[4-fluoranyl-1-(4-methylphenyl)sulfonyl-indol-3-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(dimethylamino)-1-[4-fluoranyl-1-(4-methylphenyl)sulfonyl-indol-3-yl]prop-2-en-1-one Openeye Name: (E)-3-(dimethylamino)-1-[4-fluoro-1-(p-tolylsulfonyl)indol-3-yl]prop-2-en-1-one CAS Name: (E)-3-(dimethylamino)-1-[4-fluoro-1-(4-methylphenyl)sulfonyl-3-indolyl]-2-propen-1-one IUPAC Name: (E)-3-(dimethylamino)-1-[4-fluoro-1-(4-methylphenyl)sulfonylindol-3-yl]prop-2-en-1-one Traditional Name: (E)-3-(dimethylamino)-1-(4-fluoro-1-tosyl-indol-3-yl)prop-2-en-1-one Formula: C20H19FN2O3S MolecularWeight: 386.439863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC=C3F)C(=O)C=CN(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC=C3F)C(=O)/C=C/N(C)C

InChI

InChI=1S/C20H19FN2O3S/c1-14-7-9-15(10-8-14)27(25,26)23-13-16(19(24)11-12-22(2)3)20-17(21)5-4-6-18(20)23/h4-13H,1-3H3/b12-11+