5-bromanyl-2-ethoxy-N-[[(2-propoxyphenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 5-bromanyl-2-ethoxy-N-[[(2-propoxyphenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 5-bromo-2-ethoxy-N-[[(2-propoxybenzoyl)amino]carbamothioyl]benzamide CAS Name: 5-bromo-2-ethoxy-N-[[[oxo-(2-propoxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-ethoxy-N-[[(2-propoxybenzoyl)amino]carbamothioyl]benzamide Traditional Name: 5-bromo-2-ethoxy-N-[[(2-propoxybenzoyl)amino]thiocarbamoyl]benzamide Formula: C20H22BrN3O4S MolecularWeight: 480.37538

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C(=O)NNC(=S)NC(=O)C2=C(C=CC(=C2)Br)OCC

Isomeric SMILES

CCCOC1=CC=CC=C1C(=O)NNC(=S)NC(=O)C2=C(C=CC(=C2)Br)OCC

InChI

InChI=1S/C20H22BrN3O4S/c1-3-11-28-16-8-6-5-7-14(16)19(26)23-24-20(29)22-18(25)15-12-13(21)9-10-17(15)27-4-2/h5-10,12H,3-4,11H2,1-2H3,(H,23,26)(H2,22,24,25,29)