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

Systemtic Name: 5-bromanyl-2-ethoxy-N-[[3-(2-methylprop-2-enoxy)phenyl]carbamothioyl]benzamide Openeye Name: 5-bromo-2-ethoxy-N-[[3-(2-methylallyloxy)phenyl]carbamothioyl]benzamide CAS Name: 5-bromo-2-ethoxy-N-[[3-(2-methylprop-2-enoxy)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-ethoxy-N-[[3-(2-methylprop-2-enoxy)phenyl]carbamothioyl]benzamide Traditional Name: 5-bromo-2-ethoxy-N-[[3-(2-methylallyloxy)phenyl]thiocarbamoyl]benzamide Formula: C20H21BrN2O3S MolecularWeight: 449.36134

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC(=CC=C2)OCC(=C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC(=CC=C2)OCC(=C)C

InChI

InChI=1S/C20H21BrN2O3S/c1-4-25-18-9-8-14(21)10-17(18)19(24)23-20(27)22-15-6-5-7-16(11-15)26-12-13(2)3/h5-11H,2,4,12H2,1,3H3,(H2,22,23,24,27)