2-[6-fluoranyl-2-methyl-3-[4-(1-methylimidazol-2-yl)phenyl]sulfanyl-indolizin-1-yl]ethanoic acid

Systemtic Name: 2-[6-fluoranyl-2-methyl-3-[4-(1-methylimidazol-2-yl)phenyl]sulfanyl-indolizin-1-yl]ethanoic acid Openeye Name: 2-[6-fluoro-2-methyl-3-[4-(1-methylimidazol-2-yl)phenyl]sulfanyl-indolizin-1-yl]acetic acid CAS Name: 2-[6-fluoro-2-methyl-3-[[4-(1-methyl-2-imidazolyl)phenyl]thio]-1-indolizinyl]acetic acid IUPAC Name: 2-[6-fluoro-2-methyl-3-[4-(1-methylimidazol-2-yl)phenyl]sulfanylindolizin-1-yl]acetic acid Traditional Name: 2-[6-fluoro-2-methyl-3-[[4-(1-methylimidazol-2-yl)phenyl]thio]indolizin-1-yl]acetic acid Formula: C21H18FN3O2S MolecularWeight: 395.449923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C=C(C=CC2=C1CC(=O)O)F)SC3=CC=C(C=C3)C4=NC=CN4C

Isomeric SMILES

CC1=C(N2C=C(C=CC2=C1CC(=O)O)F)SC3=CC=C(C=C3)C4=NC=CN4C

InChI

InChI=1S/C21H18FN3O2S/c1-13-17(11-19(26)27)18-8-5-15(22)12-25(18)21(13)28-16-6-3-14(4-7-16)20-23-9-10-24(20)2/h3-10,12H,11H2,1-2H3,(H,26,27)