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

Systemtic Name: 5-bromanyl-2-methoxy-N-[[2-(oxolan-2-ylmethoxy)phenyl]carbamothioyl]benzamide Openeye Name: 5-bromo-2-methoxy-N-[[2-(tetrahydrofuran-2-ylmethoxy)phenyl]carbamothioyl]benzamide CAS Name: 5-bromo-2-methoxy-N-[[2-(2-oxolanylmethoxy)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-methoxy-N-[[2-(oxolan-2-ylmethoxy)phenyl]carbamothioyl]benzamide Traditional Name: 5-bromo-2-methoxy-N-[[2-(tetrahydrofurfuryloxy)phenyl]thiocarbamoyl]benzamide Formula: C20H21BrN2O4S MolecularWeight: 465.36074

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=CC=C2OCC3CCCO3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=CC=C2OCC3CCCO3

InChI

InChI=1S/C20H21BrN2O4S/c1-25-17-9-8-13(21)11-15(17)19(24)23-20(28)22-16-6-2-3-7-18(16)27-12-14-5-4-10-26-14/h2-3,6-9,11,14H,4-5,10,12H2,1H3,(H2,22,23,24,28)