5-bromanyl-N-[[3-(2-methylprop-2-enoxy)phenyl]carbamothioyl]-2-propan-2-yloxy-benzamide

Systemtic Name: 5-bromanyl-N-[[3-(2-methylprop-2-enoxy)phenyl]carbamothioyl]-2-propan-2-yloxy-benzamide Openeye Name: 5-bromo-2-isopropoxy-N-[[3-(2-methylallyloxy)phenyl]carbamothioyl]benzamide CAS Name: 5-bromo-N-[[3-(2-methylprop-2-enoxy)anilino]-sulfanylidenemethyl]-2-propan-2-yloxybenzamide IUPAC Name: 5-bromo-N-[[3-(2-methylprop-2-enoxy)phenyl]carbamothioyl]-2-propan-2-yloxybenzamide Traditional Name: 5-bromo-2-isopropoxy-N-[[3-(2-methylallyloxy)phenyl]thiocarbamoyl]benzamide Formula: C21H23BrN2O3S MolecularWeight: 463.38792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC(=CC=C2)OCC(=C)C

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC(=CC=C2)OCC(=C)C

InChI

InChI=1S/C21H23BrN2O3S/c1-13(2)12-26-17-7-5-6-16(11-17)23-21(28)24-20(25)18-10-15(22)8-9-19(18)27-14(3)4/h5-11,14H,1,12H2,2-4H3,(H2,23,24,25,28)