N-[[(4-benzamidophenyl)carbonylamino]carbamothioyl]-3-bromanyl-4-methyl-benzamide

Systemtic Name: N-[[(4-benzamidophenyl)carbonylamino]carbamothioyl]-3-bromanyl-4-methyl-benzamide Openeye Name: N-[[(4-benzamidobenzoyl)amino]carbamothioyl]-3-bromo-4-methyl-benzamide CAS Name: N-[[[(4-benzamidophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-bromo-4-methylbenzamide IUPAC Name: N-[[(4-benzamidobenzoyl)amino]carbamothioyl]-3-bromo-4-methylbenzamide Traditional Name: N-[[(4-benzamidobenzoyl)amino]thiocarbamoyl]-3-bromo-4-methyl-benzamide Formula: C23H19BrN4O3S MolecularWeight: 511.39096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3)Br

InChI

InChI=1S/C23H19BrN4O3S/c1-14-7-8-17(13-19(14)24)21(30)26-23(32)28-27-22(31)16-9-11-18(12-10-16)25-20(29)15-5-3-2-4-6-15/h2-13H,1H3,(H,25,29)(H,27,31)(H2,26,28,30,32)