2-(2-ethoxyethoxy)-N-[[(4-hexoxyphenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 2-(2-ethoxyethoxy)-N-[[(4-hexoxyphenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 2-(2-ethoxyethoxy)-N-[[(4-hexoxybenzoyl)amino]carbamothioyl]benzamide CAS Name: 2-(2-ethoxyethoxy)-N-[[[(4-hexoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 2-(2-ethoxyethoxy)-N-[[(4-hexoxybenzoyl)amino]carbamothioyl]benzamide Traditional Name: 2-(2-ethoxyethoxy)-N-[[(4-hexoxybenzoyl)amino]thiocarbamoyl]benzamide Formula: C25H33N3O5S MolecularWeight: 487.61162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=CC=C2OCCOCC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=CC=C2OCCOCC

InChI

InChI=1S/C25H33N3O5S/c1-3-5-6-9-16-32-20-14-12-19(13-15-20)23(29)27-28-25(34)26-24(30)21-10-7-8-11-22(21)33-18-17-31-4-2/h7-8,10-15H,3-6,9,16-18H2,1-2H3,(H,27,29)(H2,26,28,30,34)