4-tert-butyl-N-[[2-(2,6-dimethylphenoxy)ethanoylamino]carbamothioyl]benzamide

Systemtic Name: 4-tert-butyl-N-[[2-(2,6-dimethylphenoxy)ethanoylamino]carbamothioyl]benzamide Openeye Name: 4-tert-butyl-N-[[[2-(2,6-dimethylphenoxy)acetyl]amino]carbamothioyl]benzamide CAS Name: 4-tert-butyl-N-[[[2-(2,6-dimethylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-tert-butyl-N-[[[2-(2,6-dimethylphenoxy)acetyl]amino]carbamothioyl]benzamide Traditional Name: 4-tert-butyl-N-[[[2-(2,6-dimethylphenoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCC(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCC(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C22H27N3O3S/c1-14-7-6-8-15(2)19(14)28-13-18(26)24-25-21(29)23-20(27)16-9-11-17(12-10-16)22(3,4)5/h6-12H,13H2,1-5H3,(H,24,26)(H2,23,25,27,29)