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

Systemtic Name: 5-bromanyl-N-[[(4-methoxyphenyl)carbonylamino]carbamothioyl]-2-(2-methylpropoxy)benzamide Openeye Name: 5-bromo-2-isobutoxy-N-[[(4-methoxybenzoyl)amino]carbamothioyl]benzamide CAS Name: 5-bromo-N-[[[(4-methoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-(2-methylpropoxy)benzamide IUPAC Name: 5-bromo-N-[[(4-methoxybenzoyl)amino]carbamothioyl]-2-(2-methylpropoxy)benzamide Traditional Name: 5-bromo-2-isobutoxy-N-[(p-anisoylamino)thiocarbamoyl]benzamide Formula: C20H22BrN3O4S MolecularWeight: 480.37538

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C20H22BrN3O4S/c1-12(2)11-28-17-9-6-14(21)10-16(17)19(26)22-20(29)24-23-18(25)13-4-7-15(27-3)8-5-13/h4-10,12H,11H2,1-3H3,(H,23,25)(H2,22,24,26,29)