3-fluoranyl-N-[6-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfanylpyridazin-3-yl]benzamide

Systemtic Name: 3-fluoranyl-N-[6-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfanylpyridazin-3-yl]benzamide Openeye Name: N-[6-[2-(benzylamino)-2-oxo-ethyl]sulfanylpyridazin-3-yl]-3-fluoro-benzamide CAS Name: 3-fluoro-N-[6-[[2-oxo-2-[(phenylmethyl)amino]ethyl]thio]-3-pyridazinyl]benzamide IUPAC Name: N-[6-[2-(benzylamino)-2-oxoethyl]sulfanylpyridazin-3-yl]-3-fluorobenzamide Traditional Name: N-[6-[[2-(benzylamino)-2-keto-ethyl]thio]pyridazin-3-yl]-3-fluoro-benzamide Formula: C20H17FN4O2S MolecularWeight: 396.437983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CSC2=NN=C(C=C2)NC(=O)C3=CC(=CC=C3)F

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CSC2=NN=C(C=C2)NC(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C20H17FN4O2S/c21-16-8-4-7-15(11-16)20(27)23-17-9-10-19(25-24-17)28-13-18(26)22-12-14-5-2-1-3-6-14/h1-11H,12-13H2,(H,22,26)(H,23,24,27)