[4-[4-(ethanoylsulfanylcarbamoylamino)-2-fluoranyl-phenoxy]pyridin-2-yl]carbamic acid

Systemtic Name: [4-[4-(ethanoylsulfanylcarbamoylamino)-2-fluoranyl-phenoxy]pyridin-2-yl]carbamic acid Openeye Name: [4-[4-(acetylsulfanylcarbamoylamino)-2-fluoro-phenoxy]-2-pyridyl]carbamic acid CAS Name: [4-[4-[[[(acetylthio)amino]-oxomethyl]amino]-2-fluorophenoxy]-2-pyridinyl]carbamic acid IUPAC Name: [4-[4-(acetylsulfanylcarbamoylamino)-2-fluorophenoxy]pyridin-2-yl]carbamic acid Traditional Name: [4-[4-[(acetylthio)carbamoylamino]-2-fluoro-phenoxy]-2-pyridyl]carbamic acid Formula: C15H13FN4O5S MolecularWeight: 380.350923

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SNC(=O)NC1=CC(=C(C=C1)OC2=CC(=NC=C2)NC(=O)O)F

Isomeric SMILES

CC(=O)SNC(=O)NC1=CC(=C(C=C1)OC2=CC(=NC=C2)NC(=O)O)F

InChI

InChI=1S/C15H13FN4O5S/c1-8(21)26-20-14(22)18-9-2-3-12(11(16)6-9)25-10-4-5-17-13(7-10)19-15(23)24/h2-7H,1H3,(H,17,19)(H,23,24)(H2,18,20,22)