5-[(5-bromanyl-2-hexoxy-phenyl)carbonylcarbamothioylamino]-2-chloranyl-N-cyclohexyl-benzamide

Systemtic Name: 5-[(5-bromanyl-2-hexoxy-phenyl)carbonylcarbamothioylamino]-2-chloranyl-N-cyclohexyl-benzamide Openeye Name: 5-[(5-bromo-2-hexoxy-benzoyl)carbamothioylamino]-2-chloro-N-cyclohexyl-benzamide CAS Name: 5-[[[[(5-bromo-2-hexoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-2-chloro-N-cyclohexylbenzamide IUPAC Name: 5-[(5-bromo-2-hexoxybenzoyl)carbamothioylamino]-2-chloro-N-cyclohexylbenzamide Traditional Name: 5-[(5-bromo-2-hexoxy-benzoyl)thiocarbamoylamino]-2-chloro-N-cyclohexyl-benzamide Formula: C27H33BrClN3O3S MolecularWeight: 594.99122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC(=C(C=C2)Cl)C(=O)NC3CCCCC3

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC(=C(C=C2)Cl)C(=O)NC3CCCCC3

InChI

InChI=1S/C27H33BrClN3O3S/c1-2-3-4-8-15-35-24-14-11-18(28)16-22(24)26(34)32-27(36)31-20-12-13-23(29)21(17-20)25(33)30-19-9-6-5-7-10-19/h11-14,16-17,19H,2-10,15H2,1H3,(H,30,33)(H2,31,32,34,36)