(E)-1-[3-(4-methylphenyl)sulfinylindol-1-yl]but-2-en-1-one

Systemtic Name: (E)-1-[3-(4-methylphenyl)sulfinylindol-1-yl]but-2-en-1-one Openeye Name: (E)-1-[3-(p-tolylsulfinyl)indol-1-yl]but-2-en-1-one CAS Name: (E)-1-[3-(4-methylphenyl)sulfinyl-1-indolyl]-2-buten-1-one IUPAC Name: (E)-1-[3-(4-methylphenyl)sulfinylindol-1-yl]but-2-en-1-one Traditional Name: (E)-1-[3-(p-tolylsulfinyl)indol-1-yl]but-2-en-1-one Formula: C19H17NO2S MolecularWeight: 323.40878

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)N1C=C(C2=CC=CC=C21)S(=O)C3=CC=C(C=C3)C

Isomeric SMILES

C/C=C/C(=O)N1C=C(C2=CC=CC=C21)S(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C19H17NO2S/c1-3-6-19(21)20-13-18(16-7-4-5-8-17(16)20)23(22)15-11-9-14(2)10-12-15/h3-13H,1-2H3/b6-3+