3-bromanyl-4-ethoxy-N-[[2-(2-propan-2-ylphenoxy)ethanoylamino]carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-ethoxy-N-[[2-(2-propan-2-ylphenoxy)ethanoylamino]carbamothioyl]benzamide Openeye Name: 3-bromo-4-ethoxy-N-[[[2-(2-isopropylphenoxy)acetyl]amino]carbamothioyl]benzamide CAS Name: 3-bromo-4-ethoxy-N-[[[1-oxo-2-(2-propan-2-ylphenoxy)ethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-ethoxy-N-[[[2-(2-propan-2-ylphenoxy)acetyl]amino]carbamothioyl]benzamide Traditional Name: 3-bromo-4-ethoxy-N-[[[2-(2-isopropylphenoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C21H24BrN3O4S MolecularWeight: 494.40196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=CC=C2C(C)C)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=CC=C2C(C)C)Br

InChI

InChI=1S/C21H24BrN3O4S/c1-4-28-18-10-9-14(11-16(18)22)20(27)23-21(30)25-24-19(26)12-29-17-8-6-5-7-15(17)13(2)3/h5-11,13H,4,12H2,1-3H3,(H,24,26)(H2,23,25,27,30)