2-fluoranyl-N-[4-(pyridin-3-ylmethylsulfanylcarbamoylamino)phenyl]benzamide

Systemtic Name: 2-fluoranyl-N-[4-(pyridin-3-ylmethylsulfanylcarbamoylamino)phenyl]benzamide Openeye Name: 2-fluoro-N-[4-(3-pyridylmethylsulfanylcarbamoylamino)phenyl]benzamide CAS Name: 2-fluoro-N-[4-[[oxo-[(3-pyridinylmethylthio)amino]methyl]amino]phenyl]benzamide IUPAC Name: 2-fluoro-N-[4-(pyridin-3-ylmethylsulfanylcarbamoylamino)phenyl]benzamide Traditional Name: 2-fluoro-N-[4-[(3-pyridylmethylthio)carbamoylamino]phenyl]benzamide Formula: C20H17FN4O2S MolecularWeight: 396.437983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)NC(=O)NSCC3=CN=CC=C3)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)NC(=O)NSCC3=CN=CC=C3)F

InChI

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