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

Systemtic Name: N-[[2-(4-butan-2-ylphenoxy)ethanoylamino]carbamothioyl]-4-chloranyl-benzamide Openeye Name: 4-chloro-N-[[[2-(4-sec-butylphenoxy)acetyl]amino]carbamothioyl]benzamide CAS Name: N-[[[2-(4-butan-2-ylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-4-chlorobenzamide IUPAC Name: N-[[[2-(4-butan-2-ylphenoxy)acetyl]amino]carbamothioyl]-4-chlorobenzamide Traditional Name: 4-chloro-N-[[[2-(4-sec-butylphenoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C20H22ClN3O3S MolecularWeight: 419.92498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClN3O3S/c1-3-13(2)14-6-10-17(11-7-14)27-12-18(25)23-24-20(28)22-19(26)15-4-8-16(21)9-5-15/h4-11,13H,3,12H2,1-2H3,(H,23,25)(H2,22,24,26,28)