2-bromanyl-N-[[3-(pentanoylamino)phenyl]carbamothioyl]benzamide

Systemtic Name: 2-bromanyl-N-[[3-(pentanoylamino)phenyl]carbamothioyl]benzamide Openeye Name: 2-bromo-N-[[3-(pentanoylamino)phenyl]carbamothioyl]benzamide CAS Name: 2-bromo-N-[[3-(1-oxopentylamino)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2-bromo-N-[[3-(pentanoylamino)phenyl]carbamothioyl]benzamide Traditional Name: 2-bromo-N-[[3-(valerylamino)phenyl]thiocarbamoyl]benzamide Formula: C19H20BrN3O2S MolecularWeight: 434.35

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=CC=C2Br

Isomeric SMILES

CCCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C19H20BrN3O2S/c1-2-3-11-17(24)21-13-7-6-8-14(12-13)22-19(26)23-18(25)15-9-4-5-10-16(15)20/h4-10,12H,2-3,11H2,1H3,(H,21,24)(H2,22,23,25,26)