N-[[2-(4-butan-2-ylphenoxy)ethanoylamino]carbamothioyl]-2-(2-methylphenyl)ethanamide

Systemtic Name: N-[[2-(4-butan-2-ylphenoxy)ethanoylamino]carbamothioyl]-2-(2-methylphenyl)ethanamide Openeye Name: 2-(o-tolyl)-N-[[[2-(4-sec-butylphenoxy)acetyl]amino]carbamothioyl]acetamide CAS Name: N-[[[2-(4-butan-2-ylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-(2-methylphenyl)acetamide IUPAC Name: N-[[[2-(4-butan-2-ylphenoxy)acetyl]amino]carbamothioyl]-2-(2-methylphenyl)acetamide Traditional Name: 2-(o-tolyl)-N-[[[2-(4-sec-butylphenoxy)acetyl]amino]thiocarbamoyl]acetamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)OCC(=O)NNC(=S)NC(=O)CC2=CC=CC=C2C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)OCC(=O)NNC(=S)NC(=O)CC2=CC=CC=C2C

InChI

InChI=1S/C22H27N3O3S/c1-4-15(2)17-9-11-19(12-10-17)28-14-21(27)24-25-22(29)23-20(26)13-18-8-6-5-7-16(18)3/h5-12,15H,4,13-14H2,1-3H3,(H,24,27)(H2,23,25,26,29)