N-[[2-(4-butan-2-ylphenoxy)ethanoylamino]carbamothioyl]-2,4-bis(chloranyl)benzamide

Systemtic Name: N-[[2-(4-butan-2-ylphenoxy)ethanoylamino]carbamothioyl]-2,4-bis(chloranyl)benzamide Openeye Name: 2,4-dichloro-N-[[[2-(4-sec-butylphenoxy)acetyl]amino]carbamothioyl]benzamide CAS Name: N-[[[2-(4-butan-2-ylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2,4-dichlorobenzamide IUPAC Name: N-[[[2-(4-butan-2-ylphenoxy)acetyl]amino]carbamothioyl]-2,4-dichlorobenzamide Traditional Name: 2,4-dichloro-N-[[[2-(4-sec-butylphenoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C20H21Cl2N3O3S MolecularWeight: 454.37004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21Cl2N3O3S/c1-3-12(2)13-4-7-15(8-5-13)28-11-18(26)24-25-20(29)23-19(27)16-9-6-14(21)10-17(16)22/h4-10,12H,3,11H2,1-2H3,(H,24,26)(H2,23,25,27,29)