4-bromanyl-N-[[(5-methyl-1,2-oxazol-3-yl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 4-bromanyl-N-[[(5-methyl-1,2-oxazol-3-yl)carbonylamino]carbamothioyl]benzamide Openeye Name: 4-bromo-N-[[(5-methylisoxazole-3-carbonyl)amino]carbamothioyl]benzamide CAS Name: 4-bromo-N-[[[(5-methyl-3-isoxazolyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-bromo-N-[[(5-methyl-1,2-oxazole-3-carbonyl)amino]carbamothioyl]benzamide Traditional Name: 4-bromo-N-[[(5-methylisoxazole-3-carbonyl)amino]thiocarbamoyl]benzamide Formula: C13H11BrN4O3S MolecularWeight: 383.22044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC1=CC(=NO1)C(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C13H11BrN4O3S/c1-7-6-10(18-21-7)12(20)16-17-13(22)15-11(19)8-2-4-9(14)5-3-8/h2-6H,1H3,(H,16,20)(H2,15,17,19,22)