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

Systemtic Name: N-[[(4-benzamidophenyl)carbonylamino]carbamothioyl]-3-bromanyl-4-butoxy-benzamide Openeye Name: N-[[(4-benzamidobenzoyl)amino]carbamothioyl]-3-bromo-4-butoxy-benzamide CAS Name: N-[[[(4-benzamidophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-bromo-4-butoxybenzamide IUPAC Name: N-[[(4-benzamidobenzoyl)amino]carbamothioyl]-3-bromo-4-butoxybenzamide Traditional Name: N-[[(4-benzamidobenzoyl)amino]thiocarbamoyl]-3-bromo-4-butoxy-benzamide Formula: C26H25BrN4O4S MolecularWeight: 569.4701

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=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

CCCCOC1=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/C26H25BrN4O4S/c1-2-3-15-35-22-14-11-19(16-21(22)27)24(33)29-26(36)31-30-25(34)18-9-12-20(13-10-18)28-23(32)17-7-5-4-6-8-17/h4-14,16H,2-3,15H2,1H3,(H,28,32)(H,30,34)(H2,29,31,33,36)