3-bromanyl-4-phenethyloxy-N-[[(2-propoxyphenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-phenethyloxy-N-[[(2-propoxyphenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 3-bromo-4-phenethyloxy-N-[[(2-propoxybenzoyl)amino]carbamothioyl]benzamide CAS Name: 3-bromo-N-[[[oxo-(2-propoxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]-4-phenethyloxybenzamide IUPAC Name: 3-bromo-4-phenethyloxy-N-[[(2-propoxybenzoyl)amino]carbamothioyl]benzamide Traditional Name: 3-bromo-4-phenethyloxy-N-[[(2-propoxybenzoyl)amino]thiocarbamoyl]benzamide Formula: C26H26BrN3O4S MolecularWeight: 556.47134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C(=O)NNC(=S)NC(=O)C2=CC(=C(C=C2)OCCC3=CC=CC=C3)Br

Isomeric SMILES

CCCOC1=CC=CC=C1C(=O)NNC(=S)NC(=O)C2=CC(=C(C=C2)OCCC3=CC=CC=C3)Br

InChI

InChI=1S/C26H26BrN3O4S/c1-2-15-33-22-11-7-6-10-20(22)25(32)29-30-26(35)28-24(31)19-12-13-23(21(27)17-19)34-16-14-18-8-4-3-5-9-18/h3-13,17H,2,14-16H2,1H3,(H,29,32)(H2,28,30,31,35)