3-bromanyl-4-(2-methoxyethoxy)-N-[(2-phenylethanoylamino)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-(2-methoxyethoxy)-N-[(2-phenylethanoylamino)carbamothioyl]benzamide Openeye Name: 3-bromo-4-(2-methoxyethoxy)-N-[[(2-phenylacetyl)amino]carbamothioyl]benzamide CAS Name: 3-bromo-4-(2-methoxyethoxy)-N-[[(1-oxo-2-phenylethyl)hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-(2-methoxyethoxy)-N-[[(2-phenylacetyl)amino]carbamothioyl]benzamide Traditional Name: 3-bromo-4-(2-methoxyethoxy)-N-[[(2-phenylacetyl)amino]thiocarbamoyl]benzamide Formula: C19H20BrN3O4S MolecularWeight: 466.3488

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)CC2=CC=CC=C2)Br

Isomeric SMILES

COCCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)CC2=CC=CC=C2)Br

InChI

InChI=1S/C19H20BrN3O4S/c1-26-9-10-27-16-8-7-14(12-15(16)20)18(25)21-19(28)23-22-17(24)11-13-5-3-2-4-6-13/h2-8,12H,9-11H2,1H3,(H,22,24)(H2,21,23,25,28)