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

Systemtic Name: 5-bromanyl-2-butoxy-N-[[[4-(2-methylpropoxy)phenyl]carbonylamino]carbamothioyl]benzamide Openeye Name: 5-bromo-2-butoxy-N-[[(4-isobutoxybenzoyl)amino]carbamothioyl]benzamide CAS Name: 5-bromo-2-butoxy-N-[[[[4-(2-methylpropoxy)phenyl]-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-butoxy-N-[[[4-(2-methylpropoxy)benzoyl]amino]carbamothioyl]benzamide Traditional Name: 5-bromo-2-butoxy-N-[[(4-isobutoxybenzoyl)amino]thiocarbamoyl]benzamide Formula: C23H28BrN3O4S MolecularWeight: 522.45512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)OCC(C)C

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)OCC(C)C

InChI

InChI=1S/C23H28BrN3O4S/c1-4-5-12-30-20-11-8-17(24)13-19(20)22(29)25-23(32)27-26-21(28)16-6-9-18(10-7-16)31-14-15(2)3/h6-11,13,15H,4-5,12,14H2,1-3H3,(H,26,28)(H2,25,27,29,32)