(E)-1-[2-(4-bromophenyl)sulfanyl-4-methyl-quinolin-3-yl]-3-(4-fluorophenyl)prop-2-en-1-one

Systemtic Name: (E)-1-[2-(4-bromophenyl)sulfanyl-4-methyl-quinolin-3-yl]-3-(4-fluorophenyl)prop-2-en-1-one Openeye Name: (E)-1-[2-(4-bromophenyl)sulfanyl-4-methyl-3-quinolyl]-3-(4-fluorophenyl)prop-2-en-1-one CAS Name: (E)-1-[2-[(4-bromophenyl)thio]-4-methyl-3-quinolinyl]-3-(4-fluorophenyl)-2-propen-1-one IUPAC Name: (E)-1-[2-(4-bromophenyl)sulfanyl-4-methylquinolin-3-yl]-3-(4-fluorophenyl)prop-2-en-1-one Traditional Name: (E)-1-[2-[(4-bromophenyl)thio]-4-methyl-3-quinolyl]-3-(4-fluorophenyl)prop-2-en-1-one Formula: C25H17BrFNOS MolecularWeight: 478.375983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)SC3=CC=C(C=C3)Br)C(=O)C=CC4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)SC3=CC=C(C=C3)Br)C(=O)/C=C/C4=CC=C(C=C4)F

InChI

InChI=1S/C25H17BrFNOS/c1-16-21-4-2-3-5-22(21)28-25(30-20-13-9-18(26)10-14-20)24(16)23(29)15-8-17-6-11-19(27)12-7-17/h2-15H,1H3/b15-8+