N-[[2-[2,4-bis(bromanyl)-6-methyl-phenoxy]ethanoylamino]carbamothioyl]-4-tert-butyl-benzamide

Systemtic Name: N-[[2-[2,4-bis(bromanyl)-6-methyl-phenoxy]ethanoylamino]carbamothioyl]-4-tert-butyl-benzamide Openeye Name: 4-tert-butyl-N-[[[2-(2,4-dibromo-6-methyl-phenoxy)acetyl]amino]carbamothioyl]benzamide CAS Name: 4-tert-butyl-N-[[[2-(2,4-dibromo-6-methylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-tert-butyl-N-[[[2-(2,4-dibromo-6-methylphenoxy)acetyl]amino]carbamothioyl]benzamide Traditional Name: 4-tert-butyl-N-[[[2-(2,4-dibromo-6-methyl-phenoxy)acetyl]amino]thiocarbamoyl]benzamide Formula: C21H23Br2N3O3S MolecularWeight: 557.29862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)C(C)(C)C)Br)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)C(C)(C)C)Br)Br

InChI

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