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

Systemtic Name: N-[[2-(4-butan-2-ylphenoxy)ethanoylamino]carbamothioyl]-2-(4-chlorophenyl)ethanamide Openeye Name: 2-(4-chlorophenyl)-N-[[[2-(4-sec-butylphenoxy)acetyl]amino]carbamothioyl]acetamide CAS Name: N-[[[2-(4-butan-2-ylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-(4-chlorophenyl)acetamide IUPAC Name: N-[[[2-(4-butan-2-ylphenoxy)acetyl]amino]carbamothioyl]-2-(4-chlorophenyl)acetamide Traditional Name: 2-(4-chlorophenyl)-N-[[[2-(4-sec-butylphenoxy)acetyl]amino]thiocarbamoyl]acetamide Formula: C21H24ClN3O3S MolecularWeight: 433.95156

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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=C(C=C2)Cl

Isomeric SMILES

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

InChI

InChI=1S/C21H24ClN3O3S/c1-3-14(2)16-6-10-18(11-7-16)28-13-20(27)24-25-21(29)23-19(26)12-15-4-8-17(22)9-5-15/h4-11,14H,3,12-13H2,1-2H3,(H,24,27)(H2,23,25,26,29)