5-bromanyl-N-[[[4-(3-methylbutoxy)phenyl]carbonylamino]carbamothioyl]-2-propan-2-yloxy-benzamide

Systemtic Name: 5-bromanyl-N-[[[4-(3-methylbutoxy)phenyl]carbonylamino]carbamothioyl]-2-propan-2-yloxy-benzamide Openeye Name: 5-bromo-N-[[(4-isopentyloxybenzoyl)amino]carbamothioyl]-2-isopropoxy-benzamide CAS Name: 5-bromo-N-[[[[4-(3-methylbutoxy)phenyl]-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-propan-2-yloxybenzamide IUPAC Name: 5-bromo-N-[[[4-(3-methylbutoxy)benzoyl]amino]carbamothioyl]-2-propan-2-yloxybenzamide Traditional Name: 5-bromo-N-[[(4-isoamoxybenzoyl)amino]thiocarbamoyl]-2-isopropoxy-benzamide Formula: C23H28BrN3O4S MolecularWeight: 522.45512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=C(C=CC(=C2)Br)OC(C)C

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=C(C=CC(=C2)Br)OC(C)C

InChI

InChI=1S/C23H28BrN3O4S/c1-14(2)11-12-30-18-8-5-16(6-9-18)21(28)26-27-23(32)25-22(29)19-13-17(24)7-10-20(19)31-15(3)4/h5-10,13-15H,11-12H2,1-4H3,(H,26,28)(H2,25,27,29,32)