N-[[2-(2-bromanyl-4-propan-2-yl-phenoxy)ethanoylamino]carbamothioyl]hexanamide

Systemtic Name: N-[[2-(2-bromanyl-4-propan-2-yl-phenoxy)ethanoylamino]carbamothioyl]hexanamide Openeye Name: N-[[[2-(2-bromo-4-isopropyl-phenoxy)acetyl]amino]carbamothioyl]hexanamide CAS Name: N-[[[2-(2-bromo-4-propan-2-ylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]hexanamide IUPAC Name: N-[[[2-(2-bromo-4-propan-2-ylphenoxy)acetyl]amino]carbamothioyl]hexanamide Traditional Name: N-[[[2-(2-bromo-4-isopropyl-phenoxy)acetyl]amino]thiocarbamoyl]hexanamide Formula: C18H26BrN3O3S MolecularWeight: 444.38634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NNC(=O)COC1=C(C=C(C=C1)C(C)C)Br

Isomeric SMILES

CCCCCC(=O)NC(=S)NNC(=O)COC1=C(C=C(C=C1)C(C)C)Br

InChI

InChI=1S/C18H26BrN3O3S/c1-4-5-6-7-16(23)20-18(26)22-21-17(24)11-25-15-9-8-13(12(2)3)10-14(15)19/h8-10,12H,4-7,11H2,1-3H3,(H,21,24)(H2,20,22,23,26)