4-tert-butyl-N-[[2-(2-chloranylphenoxy)ethanoylamino]carbamothioyl]benzamide

Systemtic Name: 4-tert-butyl-N-[[2-(2-chloranylphenoxy)ethanoylamino]carbamothioyl]benzamide Openeye Name: 4-tert-butyl-N-[[[2-(2-chlorophenoxy)acetyl]amino]carbamothioyl]benzamide CAS Name: 4-tert-butyl-N-[[[2-(2-chlorophenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-tert-butyl-N-[[[2-(2-chlorophenoxy)acetyl]amino]carbamothioyl]benzamide Traditional Name: 4-tert-butyl-N-[[[2-(2-chlorophenoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C20H22ClN3O3S MolecularWeight: 419.92498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=CC=C2Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=CC=C2Cl

InChI

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