2-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)-N-[(2,4,6-trimethylphenyl)carbamothioyl]ethanamide

Systemtic Name: 2-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)-N-[(2,4,6-trimethylphenyl)carbamothioyl]ethanamide Openeye Name: 2-(4-bromo-2-isopropyl-5-methyl-phenoxy)-N-[(2,4,6-trimethylphenyl)carbamothioyl]acetamide CAS Name: 2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)-N-[sulfanylidene-(2,4,6-trimethylanilino)methyl]acetamide IUPAC Name: 2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)-N-[(2,4,6-trimethylphenyl)carbamothioyl]acetamide Traditional Name: 2-(4-bromo-2-isopropyl-5-methyl-phenoxy)-N-(mesitylthiocarbamoyl)acetamide Formula: C22H27BrN2O2S MolecularWeight: 463.43098

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27BrN2O2S/c1-12(2)17-10-18(23)14(4)9-19(17)27-11-20(26)24-22(28)25-21-15(5)7-13(3)8-16(21)6/h7-10,12H,11H2,1-6H3,(H2,24,25,26,28)