(E)-2-ethyl-1-[4-(4-fluorophenyl)-2H-thiochromen-3-yl]pent-2-en-1-one

Systemtic Name: (E)-2-ethyl-1-[4-(4-fluorophenyl)-2H-thiochromen-3-yl]pent-2-en-1-one Openeye Name: (E)-2-ethyl-1-[4-(4-fluorophenyl)-2H-thiochromen-3-yl]pent-2-en-1-one CAS Name: (E)-2-ethyl-1-[4-(4-fluorophenyl)-2H-1-benzothiopyran-3-yl]-2-penten-1-one IUPAC Name: (E)-2-ethyl-1-[4-(4-fluorophenyl)-2H-thiochromen-3-yl]pent-2-en-1-one Traditional Name: (E)-2-ethyl-1-[4-(4-fluorophenyl)-2H-thiochromen-3-yl]pent-2-en-1-one Formula: C22H21FOS MolecularWeight: 352.464943

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Descriptors Computed from Structure

Canonical SMILES:

CCC=C(CC)C(=O)C1=C(C2=CC=CC=C2SC1)C3=CC=C(C=C3)F

Isomeric SMILES

CC/C=C(\CC)/C(=O)C1=C(C2=CC=CC=C2SC1)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H21FOS/c1-3-7-15(4-2)22(24)19-14-25-20-9-6-5-8-18(20)21(19)16-10-12-17(23)13-11-16/h5-13H,3-4,14H2,1-2H3/b15-7+