2-[3-(1,3-benzothiazol-2-ylmethyl)-5-fluoranyl-2-methyl-indol-1-yl]ethanoic acid

Systemtic Name: 2-[3-(1,3-benzothiazol-2-ylmethyl)-5-fluoranyl-2-methyl-indol-1-yl]ethanoic acid Openeye Name: 2-[3-(1,3-benzothiazol-2-ylmethyl)-5-fluoro-2-methyl-indol-1-yl]acetic acid CAS Name: 2-[3-(1,3-benzothiazol-2-ylmethyl)-5-fluoro-2-methyl-1-indolyl]acetic acid IUPAC Name: 2-[3-(1,3-benzothiazol-2-ylmethyl)-5-fluoro-2-methylindol-1-yl]acetic acid Traditional Name: 2-[3-(1,3-benzothiazol-2-ylmethyl)-5-fluoro-2-methyl-indol-1-yl]acetic acid Formula: C19H15FN2O2S MolecularWeight: 354.398003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC(=O)O)C=CC(=C2)F)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=C(C2=C(N1CC(=O)O)C=CC(=C2)F)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H15FN2O2S/c1-11-13(9-18-21-15-4-2-3-5-17(15)25-18)14-8-12(20)6-7-16(14)22(11)10-19(23)24/h2-8H,9-10H2,1H3,(H,23,24)