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

Systemtic Name: 2-(4-tert-butylphenoxy)-N-[(2-phenylethanoylamino)carbamothioyl]ethanamide Openeye Name: 2-(4-tert-butylphenoxy)-N-[[(2-phenylacetyl)amino]carbamothioyl]acetamide CAS Name: 2-(4-tert-butylphenoxy)-N-[[(1-oxo-2-phenylethyl)hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-tert-butylphenoxy)-N-[[(2-phenylacetyl)amino]carbamothioyl]acetamide Traditional Name: 2-(4-tert-butylphenoxy)-N-[[(2-phenylacetyl)amino]thiocarbamoyl]acetamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC(=O)NC(=S)NNC(=O)CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC(=O)NC(=S)NNC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C21H25N3O3S/c1-21(2,3)16-9-11-17(12-10-16)27-14-19(26)22-20(28)24-23-18(25)13-15-7-5-4-6-8-15/h4-12H,13-14H2,1-3H3,(H,23,25)(H2,22,24,26,28)