2-[5-[(3-azanyl-4-fluoranyl-phenyl)carbamoyl]pyridin-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[5-[(3-azanyl-4-fluoranyl-phenyl)carbamoyl]pyridin-2-yl]sulfanylethanoic acid Openeye Name: 2-[[5-[(3-amino-4-fluoro-phenyl)carbamoyl]-2-pyridyl]sulfanyl]acetic acid CAS Name: 2-[[5-[(3-amino-4-fluoroanilino)-oxomethyl]-2-pyridinyl]thio]acetic acid IUPAC Name: 2-[5-[(3-amino-4-fluorophenyl)carbamoyl]pyridin-2-yl]sulfanylacetic acid Traditional Name: 2-[[5-[(3-amino-4-fluoro-phenyl)carbamoyl]-2-pyridyl]thio]acetic acid Formula: C14H12FN3O3S MolecularWeight: 321.326783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)C2=CN=C(C=C2)SCC(=O)O)N)F

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)C2=CN=C(C=C2)SCC(=O)O)N)F

InChI

InChI=1S/C14H12FN3O3S/c15-10-3-2-9(5-11(10)16)18-14(21)8-1-4-12(17-6-8)22-7-13(19)20/h1-6H,7,16H2,(H,18,21)(H,19,20)