5-bromanyl-2-butoxy-N-[[2-(oxolan-2-ylmethoxy)phenyl]carbamothioyl]benzamide

Systemtic Name: 5-bromanyl-2-butoxy-N-[[2-(oxolan-2-ylmethoxy)phenyl]carbamothioyl]benzamide Openeye Name: 5-bromo-2-butoxy-N-[[2-(tetrahydrofuran-2-ylmethoxy)phenyl]carbamothioyl]benzamide CAS Name: 5-bromo-2-butoxy-N-[[2-(2-oxolanylmethoxy)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-butoxy-N-[[2-(oxolan-2-ylmethoxy)phenyl]carbamothioyl]benzamide Traditional Name: 5-bromo-2-butoxy-N-[[2-(tetrahydrofurfuryloxy)phenyl]thiocarbamoyl]benzamide Formula: C23H27BrN2O4S MolecularWeight: 507.44048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=CC=C2OCC3CCCO3

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=CC=C2OCC3CCCO3

InChI

InChI=1S/C23H27BrN2O4S/c1-2-3-12-29-20-11-10-16(24)14-18(20)22(27)26-23(31)25-19-8-4-5-9-21(19)30-15-17-7-6-13-28-17/h4-5,8-11,14,17H,2-3,6-7,12-13,15H2,1H3,(H2,25,26,27,31)