3-bromanyl-N-[[2-(oxolan-2-ylmethoxy)phenyl]carbamothioyl]-4-propan-2-yloxy-benzamide

Systemtic Name: 3-bromanyl-N-[[2-(oxolan-2-ylmethoxy)phenyl]carbamothioyl]-4-propan-2-yloxy-benzamide Openeye Name: 3-bromo-4-isopropoxy-N-[[2-(tetrahydrofuran-2-ylmethoxy)phenyl]carbamothioyl]benzamide CAS Name: 3-bromo-N-[[2-(2-oxolanylmethoxy)anilino]-sulfanylidenemethyl]-4-propan-2-yloxybenzamide IUPAC Name: 3-bromo-N-[[2-(oxolan-2-ylmethoxy)phenyl]carbamothioyl]-4-propan-2-yloxybenzamide Traditional Name: 3-bromo-4-isopropoxy-N-[[2-(tetrahydrofurfuryloxy)phenyl]thiocarbamoyl]benzamide Formula: C22H25BrN2O4S MolecularWeight: 493.4139

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2OCC3CCCO3)Br

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2OCC3CCCO3)Br

InChI

InChI=1S/C22H25BrN2O4S/c1-14(2)29-19-10-9-15(12-17(19)23)21(26)25-22(30)24-18-7-3-4-8-20(18)28-13-16-6-5-11-27-16/h3-4,7-10,12,14,16H,5-6,11,13H2,1-2H3,(H2,24,25,26,30)