N-[[[4-(butanoylamino)phenyl]carbonylamino]carbamothioyl]-2-pentoxy-benzamide

Systemtic Name: N-[[[4-(butanoylamino)phenyl]carbonylamino]carbamothioyl]-2-pentoxy-benzamide Openeye Name: N-[[[4-(butanoylamino)benzoyl]amino]carbamothioyl]-2-pentoxy-benzamide CAS Name: N-[[[oxo-[4-(1-oxobutylamino)phenyl]methyl]hydrazo]-sulfanylidenemethyl]-2-pentoxybenzamide IUPAC Name: N-[[[4-(butanoylamino)benzoyl]amino]carbamothioyl]-2-pentoxybenzamide Traditional Name: 2-amoxy-N-[[(4-butyramidobenzoyl)amino]thiocarbamoyl]benzamide Formula: C24H30N4O4S MolecularWeight: 470.5844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)NC(=O)CCC

Isomeric SMILES

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)NC(=O)CCC

InChI

InChI=1S/C24H30N4O4S/c1-3-5-8-16-32-20-11-7-6-10-19(20)23(31)26-24(33)28-27-22(30)17-12-14-18(15-13-17)25-21(29)9-4-2/h6-7,10-15H,3-5,8-9,16H2,1-2H3,(H,25,29)(H,27,30)(H2,26,28,31,33)