3-bromanyl-N-[[2-(2-bromanyl-4-propan-2-yl-phenoxy)ethanoylamino]carbamothioyl]-4-butoxy-benzamide

Systemtic Name: 3-bromanyl-N-[[2-(2-bromanyl-4-propan-2-yl-phenoxy)ethanoylamino]carbamothioyl]-4-butoxy-benzamide Openeye Name: 3-bromo-N-[[[2-(2-bromo-4-isopropyl-phenoxy)acetyl]amino]carbamothioyl]-4-butoxy-benzamide CAS Name: 3-bromo-N-[[[2-(2-bromo-4-propan-2-ylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-4-butoxybenzamide IUPAC Name: 3-bromo-N-[[[2-(2-bromo-4-propan-2-ylphenoxy)acetyl]amino]carbamothioyl]-4-butoxybenzamide Traditional Name: 3-bromo-N-[[[2-(2-bromo-4-isopropyl-phenoxy)acetyl]amino]thiocarbamoyl]-4-butoxy-benzamide Formula: C23H27Br2N3O4S MolecularWeight: 601.35118

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27Br2N3O4S/c1-4-5-10-31-19-9-7-16(12-18(19)25)22(30)26-23(33)28-27-21(29)13-32-20-8-6-15(14(2)3)11-17(20)24/h6-9,11-12,14H,4-5,10,13H2,1-3H3,(H,27,29)(H2,26,28,30,33)