2-[3-[(5-chloranyl-3-pyridin-2-ylsulfonyl-thiophen-2-yl)methyl]-5-fluoranyl-2-methyl-indol-1-yl]ethanoic acid

Systemtic Name: 2-[3-[(5-chloranyl-3-pyridin-2-ylsulfonyl-thiophen-2-yl)methyl]-5-fluoranyl-2-methyl-indol-1-yl]ethanoic acid Openeye Name: 2-[3-[[5-chloro-3-(2-pyridylsulfonyl)-2-thienyl]methyl]-5-fluoro-2-methyl-indol-1-yl]acetic acid CAS Name: 2-[3-[[5-chloro-3-(2-pyridinylsulfonyl)-2-thiophenyl]methyl]-5-fluoro-2-methyl-1-indolyl]acetic acid IUPAC Name: 2-[3-[(5-chloro-3-pyridin-2-ylsulfonylthiophen-2-yl)methyl]-5-fluoro-2-methylindol-1-yl]acetic acid Traditional Name: 2-[3-[[5-chloro-3-(2-pyridylsulfonyl)-2-thienyl]methyl]-5-fluoro-2-methyl-indol-1-yl]acetic acid Formula: C21H16ClFN2O4S2 MolecularWeight: 478.944143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC(=O)O)C=CC(=C2)F)CC3=C(C=C(S3)Cl)S(=O)(=O)C4=CC=CC=N4

Isomeric SMILES

CC1=C(C2=C(N1CC(=O)O)C=CC(=C2)F)CC3=C(C=C(S3)Cl)S(=O)(=O)C4=CC=CC=N4

InChI

InChI=1S/C21H16ClFN2O4S2/c1-12-14(15-8-13(23)5-6-16(15)25(12)11-21(26)27)9-17-18(10-19(22)30-17)31(28,29)20-4-2-3-7-24-20/h2-8,10H,9,11H2,1H3,(H,26,27)