2-[5-fluoranyl-2-methyl-1-[(2-phenyl-1,3-thiazol-4-yl)methyl]indol-3-yl]ethanoic acid

Systemtic Name: 2-[5-fluoranyl-2-methyl-1-[(2-phenyl-1,3-thiazol-4-yl)methyl]indol-3-yl]ethanoic acid Openeye Name: 2-[5-fluoro-2-methyl-1-[(2-phenylthiazol-4-yl)methyl]indol-3-yl]acetic acid CAS Name: 2-[5-fluoro-2-methyl-1-[(2-phenyl-4-thiazolyl)methyl]-3-indolyl]acetic acid IUPAC Name: 2-[5-fluoro-2-methyl-1-[(2-phenyl-1,3-thiazol-4-yl)methyl]indol-3-yl]acetic acid Traditional Name: 2-[5-fluoro-2-methyl-1-[(2-phenylthiazol-4-yl)methyl]indol-3-yl]acetic acid Formula: C21H17FN2O2S MolecularWeight: 380.435283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CSC(=N3)C4=CC=CC=C4)C=CC(=C2)F)CC(=O)O

Isomeric SMILES

CC1=C(C2=C(N1CC3=CSC(=N3)C4=CC=CC=C4)C=CC(=C2)F)CC(=O)O

InChI

InChI=1S/C21H17FN2O2S/c1-13-17(10-20(25)26)18-9-15(22)7-8-19(18)24(13)11-16-12-27-21(23-16)14-5-3-2-4-6-14/h2-9,12H,10-11H2,1H3,(H,25,26)