N-[[2-(2-bromanyl-4-tert-butyl-phenoxy)ethanoylamino]carbamothioyl]cyclopropanecarboxamide

Systemtic Name: N-[[2-(2-bromanyl-4-tert-butyl-phenoxy)ethanoylamino]carbamothioyl]cyclopropanecarboxamide Openeye Name: N-[[[2-(2-bromo-4-tert-butyl-phenoxy)acetyl]amino]carbamothioyl]cyclopropanecarboxamide CAS Name: N-[[[2-(2-bromo-4-tert-butylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]cyclopropanecarboxamide IUPAC Name: N-[[[2-(2-bromo-4-tert-butylphenoxy)acetyl]amino]carbamothioyl]cyclopropanecarboxamide Traditional Name: N-[[[2-(2-bromo-4-tert-butyl-phenoxy)acetyl]amino]thiocarbamoyl]cyclopropanecarboxamide Formula: C17H22BrN3O3S MolecularWeight: 428.34388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OCC(=O)NNC(=S)NC(=O)C2CC2)Br

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OCC(=O)NNC(=S)NC(=O)C2CC2)Br

InChI

InChI=1S/C17H22BrN3O3S/c1-17(2,3)11-6-7-13(12(18)8-11)24-9-14(22)20-21-16(25)19-15(23)10-4-5-10/h6-8,10H,4-5,9H2,1-3H3,(H,20,22)(H2,19,21,23,25)