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

Systemtic Name: 2-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)-N-[(3,4-dimethylphenyl)carbamothioyl]ethanamide Openeye Name: 2-(4-bromo-2-isopropyl-5-methyl-phenoxy)-N-[(3,4-dimethylphenyl)carbamothioyl]acetamide CAS Name: 2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)-N-[(3,4-dimethylanilino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)-N-[(3,4-dimethylphenyl)carbamothioyl]acetamide Traditional Name: 2-(4-bromo-2-isopropyl-5-methyl-phenoxy)-N-[(3,4-dimethylphenyl)thiocarbamoyl]acetamide Formula: C21H25BrN2O2S MolecularWeight: 449.4044

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25BrN2O2S/c1-12(2)17-10-18(22)15(5)9-19(17)26-11-20(25)24-21(27)23-16-7-6-13(3)14(4)8-16/h6-10,12H,11H2,1-5H3,(H2,23,24,25,27)