5-bromanyl-N-[(3-ethoxypropanoylamino)carbamothioyl]-2-propan-2-yloxy-benzamide

Systemtic Name: 5-bromanyl-N-[(3-ethoxypropanoylamino)carbamothioyl]-2-propan-2-yloxy-benzamide Openeye Name: 5-bromo-N-[(3-ethoxypropanoylamino)carbamothioyl]-2-isopropoxy-benzamide CAS Name: 5-bromo-N-[[(3-ethoxy-1-oxopropyl)hydrazo]-sulfanylidenemethyl]-2-propan-2-yloxybenzamide IUPAC Name: 5-bromo-N-[(3-ethoxypropanoylamino)carbamothioyl]-2-propan-2-yloxybenzamide Traditional Name: 5-bromo-N-[(3-ethoxypropanoylamino)thiocarbamoyl]-2-isopropoxy-benzamide Formula: C16H22BrN3O4S MolecularWeight: 432.33258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCC(=O)NNC(=S)NC(=O)C1=C(C=CC(=C1)Br)OC(C)C

Isomeric SMILES

CCOCCC(=O)NNC(=S)NC(=O)C1=C(C=CC(=C1)Br)OC(C)C

InChI

InChI=1S/C16H22BrN3O4S/c1-4-23-8-7-14(21)19-20-16(25)18-15(22)12-9-11(17)5-6-13(12)24-10(2)3/h5-6,9-10H,4,7-8H2,1-3H3,(H,19,21)(H2,18,20,22,25)