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

Systemtic Name: 2-fluoranyl-N-[4-(pyridin-4-ylmethylsulfanylcarbamoylamino)phenyl]benzamide Openeye Name: 2-fluoro-N-[4-(4-pyridylmethylsulfanylcarbamoylamino)phenyl]benzamide CAS Name: 2-fluoro-N-[4-[[oxo-[(pyridin-4-ylmethylthio)amino]methyl]amino]phenyl]benzamide IUPAC Name: 2-fluoro-N-[4-(pyridin-4-ylmethylsulfanylcarbamoylamino)phenyl]benzamide Traditional Name: 2-fluoro-N-[4-[(4-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=CC=NC=C3)F

Isomeric SMILES

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

InChI

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