N-[[(4-acetamidophenyl)carbonylamino]carbamothioyl]-2-(4-bromanyl-3-methyl-phenoxy)ethanamide

Systemtic Name: N-[[(4-acetamidophenyl)carbonylamino]carbamothioyl]-2-(4-bromanyl-3-methyl-phenoxy)ethanamide Openeye Name: N-[[(4-acetamidobenzoyl)amino]carbamothioyl]-2-(4-bromo-3-methyl-phenoxy)acetamide CAS Name: N-[[[(4-acetamidophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-(4-bromo-3-methylphenoxy)acetamide IUPAC Name: N-[[(4-acetamidobenzoyl)amino]carbamothioyl]-2-(4-bromo-3-methylphenoxy)acetamide Traditional Name: N-[[(4-acetamidobenzoyl)amino]thiocarbamoyl]-2-(4-bromo-3-methyl-phenoxy)acetamide Formula: C19H19BrN4O4S MolecularWeight: 479.34756

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19BrN4O4S/c1-11-9-15(7-8-16(11)20)28-10-17(26)22-19(29)24-23-18(27)13-3-5-14(6-4-13)21-12(2)25/h3-9H,10H2,1-2H3,(H,21,25)(H,23,27)(H2,22,24,26,29)