N-[[[4-(butanoylamino)phenyl]carbonylamino]carbamothioyl]-3-(2-ethoxyethoxy)benzamide

Systemtic Name: N-[[[4-(butanoylamino)phenyl]carbonylamino]carbamothioyl]-3-(2-ethoxyethoxy)benzamide Openeye Name: N-[[[4-(butanoylamino)benzoyl]amino]carbamothioyl]-3-(2-ethoxyethoxy)benzamide CAS Name: 3-(2-ethoxyethoxy)-N-[[[oxo-[4-(1-oxobutylamino)phenyl]methyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[[4-(butanoylamino)benzoyl]amino]carbamothioyl]-3-(2-ethoxyethoxy)benzamide Traditional Name: N-[[(4-butyramidobenzoyl)amino]thiocarbamoyl]-3-(2-ethoxyethoxy)benzamide Formula: C23H28N4O5S MolecularWeight: 472.55722

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC(=CC=C2)OCCOCC

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC(=CC=C2)OCCOCC

InChI

InChI=1S/C23H28N4O5S/c1-3-6-20(28)24-18-11-9-16(10-12-18)22(30)26-27-23(33)25-21(29)17-7-5-8-19(15-17)32-14-13-31-4-2/h5,7-12,15H,3-4,6,13-14H2,1-2H3,(H,24,28)(H,26,30)(H2,25,27,29,33)