N-[6-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]sulfanylpyridazin-3-yl]-2-fluoranyl-benzamide

Systemtic Name: N-[6-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]sulfanylpyridazin-3-yl]-2-fluoranyl-benzamide Openeye Name: N-[6-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl]sulfanylpyridazin-3-yl]-2-fluoro-benzamide CAS Name: N-[6-[[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]thio]-3-pyridazinyl]-2-fluorobenzamide IUPAC Name: N-[6-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]sulfanylpyridazin-3-yl]-2-fluorobenzamide Traditional Name: N-[6-[[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl]thio]pyridazin-3-yl]-2-fluoro-benzamide Formula: C20H15FN4O4S MolecularWeight: 426.420903

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NN=C(C=C3)NC(=O)C4=CC=CC=C4F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NN=C(C=C3)NC(=O)C4=CC=CC=C4F

InChI

InChI=1S/C20H15FN4O4S/c21-14-4-2-1-3-13(14)20(27)23-17-7-8-19(25-24-17)30-10-18(26)22-12-5-6-15-16(9-12)29-11-28-15/h1-9H,10-11H2,(H,22,26)(H,23,24,27)