N-[[(4-benzamidophenyl)carbonylamino]carbamothioyl]-5-bromanyl-2-(2-methylpropoxy)benzamide

Systemtic Name: N-[[(4-benzamidophenyl)carbonylamino]carbamothioyl]-5-bromanyl-2-(2-methylpropoxy)benzamide Openeye Name: N-[[(4-benzamidobenzoyl)amino]carbamothioyl]-5-bromo-2-isobutoxy-benzamide CAS Name: N-[[[(4-benzamidophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-5-bromo-2-(2-methylpropoxy)benzamide IUPAC Name: N-[[(4-benzamidobenzoyl)amino]carbamothioyl]-5-bromo-2-(2-methylpropoxy)benzamide Traditional Name: N-[[(4-benzamidobenzoyl)amino]thiocarbamoyl]-5-bromo-2-isobutoxy-benzamide Formula: C26H25BrN4O4S MolecularWeight: 569.4701

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C26H25BrN4O4S/c1-16(2)15-35-22-13-10-19(27)14-21(22)25(34)29-26(36)31-30-24(33)18-8-11-20(12-9-18)28-23(32)17-6-4-3-5-7-17/h3-14,16H,15H2,1-2H3,(H,28,32)(H,30,33)(H2,29,31,34,36)