3-bromanyl-N-[[2-(4-butan-2-ylphenoxy)ethanoylamino]carbamothioyl]-4-butoxy-benzamide

Systemtic Name: 3-bromanyl-N-[[2-(4-butan-2-ylphenoxy)ethanoylamino]carbamothioyl]-4-butoxy-benzamide Openeye Name: 3-bromo-4-butoxy-N-[[[2-(4-sec-butylphenoxy)acetyl]amino]carbamothioyl]benzamide CAS Name: 3-bromo-N-[[[2-(4-butan-2-ylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-4-butoxybenzamide IUPAC Name: 3-bromo-N-[[[2-(4-butan-2-ylphenoxy)acetyl]amino]carbamothioyl]-4-butoxybenzamide Traditional Name: 3-bromo-4-butoxy-N-[[[2-(4-sec-butylphenoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C24H30BrN3O4S MolecularWeight: 536.4817

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=C(C=C2)C(C)CC)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=C(C=C2)C(C)CC)Br

InChI

InChI=1S/C24H30BrN3O4S/c1-4-6-13-31-21-12-9-18(14-20(21)25)23(30)26-24(33)28-27-22(29)15-32-19-10-7-17(8-11-19)16(3)5-2/h7-12,14,16H,4-6,13,15H2,1-3H3,(H,27,29)(H2,26,28,30,33)