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

Systemtic Name: N-[[[4-(butanoylamino)phenyl]carbonylamino]carbamothioyl]-4-hexoxy-benzamide Openeye Name: N-[[[4-(butanoylamino)benzoyl]amino]carbamothioyl]-4-hexoxy-benzamide CAS Name: 4-hexoxy-N-[[[oxo-[4-(1-oxobutylamino)phenyl]methyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[[4-(butanoylamino)benzoyl]amino]carbamothioyl]-4-hexoxybenzamide Traditional Name: N-[[(4-butyramidobenzoyl)amino]thiocarbamoyl]-4-hexoxy-benzamide Formula: C25H32N4O4S MolecularWeight: 484.61098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)NC(=O)CCC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)NC(=O)CCC

InChI

InChI=1S/C25H32N4O4S/c1-3-5-6-7-17-33-21-15-11-18(12-16-21)23(31)27-25(34)29-28-24(32)19-9-13-20(14-10-19)26-22(30)8-4-2/h9-16H,3-8,17H2,1-2H3,(H,26,30)(H,28,32)(H2,27,29,31,34)