N-[(5-butan-2-yl-2-oxidanyl-phenyl)carbamothioyl]-2-(4-ethylphenoxy)ethanamide

Systemtic Name: N-[(5-butan-2-yl-2-oxidanyl-phenyl)carbamothioyl]-2-(4-ethylphenoxy)ethanamide Openeye Name: 2-(4-ethylphenoxy)-N-[(2-hydroxy-5-sec-butyl-phenyl)carbamothioyl]acetamide CAS Name: N-[(5-butan-2-yl-2-hydroxyanilino)-sulfanylidenemethyl]-2-(4-ethylphenoxy)acetamide IUPAC Name: N-[(5-butan-2-yl-2-hydroxyphenyl)carbamothioyl]-2-(4-ethylphenoxy)acetamide Traditional Name: 2-(4-ethylphenoxy)-N-[(2-hydroxy-5-sec-butyl-phenyl)thiocarbamoyl]acetamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC(=O)NC(=S)NC2=C(C=CC(=C2)C(C)CC)O

Isomeric SMILES

CCC1=CC=C(C=C1)OCC(=O)NC(=S)NC2=C(C=CC(=C2)C(C)CC)O

InChI

InChI=1S/C21H26N2O3S/c1-4-14(3)16-8-11-19(24)18(12-16)22-21(27)23-20(25)13-26-17-9-6-15(5-2)7-10-17/h6-12,14,24H,4-5,13H2,1-3H3,(H2,22,23,25,27)