2-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)-N-[[2-(3-methylphenoxy)ethanoylamino]carbamothioyl]ethanamide

Systemtic Name: 2-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)-N-[[2-(3-methylphenoxy)ethanoylamino]carbamothioyl]ethanamide Openeye Name: 2-(4-bromo-2-isopropyl-5-methyl-phenoxy)-N-[[[2-(3-methylphenoxy)acetyl]amino]carbamothioyl]acetamide CAS Name: 2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)-N-[[[2-(3-methylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)-N-[[[2-(3-methylphenoxy)acetyl]amino]carbamothioyl]acetamide Traditional Name: 2-(4-bromo-2-isopropyl-5-methyl-phenoxy)-N-[[[2-(3-methylphenoxy)acetyl]amino]thiocarbamoyl]acetamide Formula: C22H26BrN3O4S MolecularWeight: 508.42854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)NNC(=S)NC(=O)COC2=C(C=C(C(=C2)C)Br)C(C)C

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)NNC(=S)NC(=O)COC2=C(C=C(C(=C2)C)Br)C(C)C

InChI

InChI=1S/C22H26BrN3O4S/c1-13(2)17-10-18(23)15(4)9-19(17)30-11-20(27)24-22(31)26-25-21(28)12-29-16-7-5-6-14(3)8-16/h5-10,13H,11-12H2,1-4H3,(H,25,28)(H2,24,26,27,31)