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

Systemtic Name: 2-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)-N-[(2,5-dimethoxyphenyl)carbamothioyl]ethanamide Openeye Name: 2-(4-bromo-2-isopropyl-5-methyl-phenoxy)-N-[(2,5-dimethoxyphenyl)carbamothioyl]acetamide CAS Name: 2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)-N-[(2,5-dimethoxyanilino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)-N-[(2,5-dimethoxyphenyl)carbamothioyl]acetamide Traditional Name: 2-(4-bromo-2-isopropyl-5-methyl-phenoxy)-N-[(2,5-dimethoxyphenyl)thiocarbamoyl]acetamide Formula: C21H25BrN2O4S MolecularWeight: 481.4032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C(C)C)OCC(=O)NC(=S)NC2=C(C=CC(=C2)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1Br)C(C)C)OCC(=O)NC(=S)NC2=C(C=CC(=C2)OC)OC

InChI

InChI=1S/C21H25BrN2O4S/c1-12(2)15-10-16(22)13(3)8-19(15)28-11-20(25)24-21(29)23-17-9-14(26-4)6-7-18(17)27-5/h6-10,12H,11H2,1-5H3,(H2,23,24,25,29)