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

Systemtic Name: 3-bromanyl-4-butoxy-N-[[(4-tert-butylphenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 3-bromo-4-butoxy-N-[[(4-tert-butylbenzoyl)amino]carbamothioyl]benzamide CAS Name: 3-bromo-4-butoxy-N-[[[(4-tert-butylphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-butoxy-N-[[(4-tert-butylbenzoyl)amino]carbamothioyl]benzamide Traditional Name: 3-bromo-4-butoxy-N-[[(4-tert-butylbenzoyl)amino]thiocarbamoyl]benzamide Formula: C23H28BrN3O3S MolecularWeight: 506.45572

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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)C(C)(C)C)Br

Isomeric SMILES

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

InChI

InChI=1S/C23H28BrN3O3S/c1-5-6-13-30-19-12-9-16(14-18(19)24)20(28)25-22(31)27-26-21(29)15-7-10-17(11-8-15)23(2,3)4/h7-12,14H,5-6,13H2,1-4H3,(H,26,29)(H2,25,27,28,31)