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

Systemtic Name: 4-(2-ethoxyethoxy)-N-[[(4-hexoxyphenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 4-(2-ethoxyethoxy)-N-[[(4-hexoxybenzoyl)amino]carbamothioyl]benzamide CAS Name: 4-(2-ethoxyethoxy)-N-[[[(4-hexoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-(2-ethoxyethoxy)-N-[[(4-hexoxybenzoyl)amino]carbamothioyl]benzamide Traditional Name: 4-(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=C(C=C2)OCCOCC

Isomeric SMILES

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

InChI

InChI=1S/C25H33N3O5S/c1-3-5-6-7-16-32-21-14-10-20(11-15-21)24(30)27-28-25(34)26-23(29)19-8-12-22(13-9-19)33-18-17-31-4-2/h8-15H,3-7,16-18H2,1-2H3,(H,27,30)(H2,26,28,29,34)