3-bromanyl-N-[[3-(2-methylprop-2-enoxy)phenyl]carbamothioyl]-4-propoxy-benzamide

Systemtic Name: 3-bromanyl-N-[[3-(2-methylprop-2-enoxy)phenyl]carbamothioyl]-4-propoxy-benzamide Openeye Name: 3-bromo-N-[[3-(2-methylallyloxy)phenyl]carbamothioyl]-4-propoxy-benzamide CAS Name: 3-bromo-N-[[3-(2-methylprop-2-enoxy)anilino]-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: 3-bromo-N-[[3-(2-methylprop-2-enoxy)phenyl]carbamothioyl]-4-propoxybenzamide Traditional Name: 3-bromo-N-[[3-(2-methylallyloxy)phenyl]thiocarbamoyl]-4-propoxy-benzamide Formula: C21H23BrN2O3S MolecularWeight: 463.38792

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)OCC(=C)C)Br

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)OCC(=C)C)Br

InChI

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