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

Systemtic Name: 3-bromanyl-N-[[2-(4-bromanyl-2-methyl-phenoxy)ethanoylamino]carbamothioyl]-4-tert-butyl-benzamide Openeye Name: 3-bromo-N-[[[2-(4-bromo-2-methyl-phenoxy)acetyl]amino]carbamothioyl]-4-tert-butyl-benzamide CAS Name: 3-bromo-N-[[[2-(4-bromo-2-methylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-4-tert-butylbenzamide IUPAC Name: 3-bromo-N-[[[2-(4-bromo-2-methylphenoxy)acetyl]amino]carbamothioyl]-4-tert-butylbenzamide Traditional Name: 3-bromo-N-[[[2-(4-bromo-2-methyl-phenoxy)acetyl]amino]thiocarbamoyl]-4-tert-butyl-benzamide Formula: C21H23Br2N3O3S MolecularWeight: 557.29862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)OCC(=O)NNC(=S)NC(=O)C2=CC(=C(C=C2)C(C)(C)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)Br)OCC(=O)NNC(=S)NC(=O)C2=CC(=C(C=C2)C(C)(C)C)Br

InChI

InChI=1S/C21H23Br2N3O3S/c1-12-9-14(22)6-8-17(12)29-11-18(27)25-26-20(30)24-19(28)13-5-7-15(16(23)10-13)21(2,3)4/h5-10H,11H2,1-4H3,(H,25,27)(H2,24,26,28,30)