3-bromanyl-4-tert-butyl-N-[[2-(4-methoxyphenoxy)ethanoylamino]carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-tert-butyl-N-[[2-(4-methoxyphenoxy)ethanoylamino]carbamothioyl]benzamide Openeye Name: 3-bromo-4-tert-butyl-N-[[[2-(4-methoxyphenoxy)acetyl]amino]carbamothioyl]benzamide CAS Name: 3-bromo-4-tert-butyl-N-[[[2-(4-methoxyphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-tert-butyl-N-[[[2-(4-methoxyphenoxy)acetyl]amino]carbamothioyl]benzamide Traditional Name: 3-bromo-4-tert-butyl-N-[[[2-(4-methoxyphenoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C21H24BrN3O4S MolecularWeight: 494.40196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=C(C=C2)OC)Br

Isomeric SMILES

CC(C)(C)C1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=C(C=C2)OC)Br

InChI

InChI=1S/C21H24BrN3O4S/c1-21(2,3)16-10-5-13(11-17(16)22)19(27)23-20(30)25-24-18(26)12-29-15-8-6-14(28-4)7-9-15/h5-11H,12H2,1-4H3,(H,24,26)(H2,23,25,27,30)