2-(4-tert-butylphenoxy)-N-[(3-phenylpropanoylamino)carbamothioyl]ethanamide

Systemtic Name: 2-(4-tert-butylphenoxy)-N-[(3-phenylpropanoylamino)carbamothioyl]ethanamide Openeye Name: 2-(4-tert-butylphenoxy)-N-[(3-phenylpropanoylamino)carbamothioyl]acetamide CAS Name: 2-(4-tert-butylphenoxy)-N-[[(1-oxo-3-phenylpropyl)hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-tert-butylphenoxy)-N-[(3-phenylpropanoylamino)carbamothioyl]acetamide Traditional Name: 2-(4-tert-butylphenoxy)-N-[(hydrocinnamoylamino)thiocarbamoyl]acetamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC(=O)NC(=S)NNC(=O)CCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC(=O)NC(=S)NNC(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C22H27N3O3S/c1-22(2,3)17-10-12-18(13-11-17)28-15-20(27)23-21(29)25-24-19(26)14-9-16-7-5-4-6-8-16/h4-8,10-13H,9,14-15H2,1-3H3,(H,24,26)(H2,23,25,27,29)