3-bromanyl-4-ethoxy-N-[[3-(ethylcarbamoyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-ethoxy-N-[[3-(ethylcarbamoyl)phenyl]carbamothioyl]benzamide Openeye Name: 3-bromo-4-ethoxy-N-[[3-(ethylcarbamoyl)phenyl]carbamothioyl]benzamide CAS Name: 3-bromo-4-ethoxy-N-[[3-(ethylcarbamoyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-ethoxy-N-[[3-(ethylcarbamoyl)phenyl]carbamothioyl]benzamide Traditional Name: 3-bromo-4-ethoxy-N-[[3-(ethylcarbamoyl)phenyl]thiocarbamoyl]benzamide Formula: C19H20BrN3O3S MolecularWeight: 450.3494

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20BrN3O3S/c1-3-21-17(24)12-6-5-7-14(10-12)22-19(27)23-18(25)13-8-9-16(26-4-2)15(20)11-13/h5-11H,3-4H2,1-2H3,(H,21,24)(H2,22,23,25,27)