3-bromanyl-4-ethoxy-N-[(2-methylquinolin-5-yl)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-ethoxy-N-[(2-methylquinolin-5-yl)carbamothioyl]benzamide Openeye Name: 3-bromo-4-ethoxy-N-[(2-methyl-5-quinolyl)carbamothioyl]benzamide CAS Name: 3-bromo-4-ethoxy-N-[[(2-methyl-5-quinolinyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-ethoxy-N-[(2-methylquinolin-5-yl)carbamothioyl]benzamide Traditional Name: 3-bromo-4-ethoxy-N-[(2-methyl-5-quinolyl)thiocarbamoyl]benzamide Formula: C20H18BrN3O2S MolecularWeight: 444.34482

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC3=C2C=CC(=N3)C)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC3=C2C=CC(=N3)C)Br

InChI

InChI=1S/C20H18BrN3O2S/c1-3-26-18-10-8-13(11-15(18)21)19(25)24-20(27)23-17-6-4-5-16-14(17)9-7-12(2)22-16/h4-11H,3H2,1-2H3,(H2,23,24,25,27)