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

Systemtic Name: 2-(4-tert-butylphenoxy)-N-[(2,2-diphenylethanoylamino)carbamothioyl]ethanamide Openeye Name: 2-(4-tert-butylphenoxy)-N-[[(2,2-diphenylacetyl)amino]carbamothioyl]acetamide CAS Name: 2-(4-tert-butylphenoxy)-N-[[(1-oxo-2,2-diphenylethyl)hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-tert-butylphenoxy)-N-[[(2,2-diphenylacetyl)amino]carbamothioyl]acetamide Traditional Name: 2-(4-tert-butylphenoxy)-N-[[(2,2-diphenylacetyl)amino]thiocarbamoyl]acetamide Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC(=O)NC(=S)NNC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC(=O)NC(=S)NNC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H29N3O3S/c1-27(2,3)21-14-16-22(17-15-21)33-18-23(31)28-26(34)30-29-25(32)24(19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-17,24H,18H2,1-3H3,(H,29,32)(H2,28,30,31,34)