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

Systemtic Name: N-[(4-acetamidophenyl)carbamothioyl]-2-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)ethanamide Openeye Name: N-[(4-acetamidophenyl)carbamothioyl]-2-(4-bromo-2-isopropyl-5-methyl-phenoxy)acetamide CAS Name: N-[(4-acetamidoanilino)-sulfanylidenemethyl]-2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)acetamide IUPAC Name: N-[(4-acetamidophenyl)carbamothioyl]-2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)acetamide Traditional Name: N-[(4-acetamidophenyl)thiocarbamoyl]-2-(4-bromo-2-isopropyl-5-methyl-phenoxy)acetamide Formula: C21H24BrN3O3S MolecularWeight: 478.40256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24BrN3O3S/c1-12(2)17-10-18(22)13(3)9-19(17)28-11-20(27)25-21(29)24-16-7-5-15(6-8-16)23-14(4)26/h5-10,12H,11H2,1-4H3,(H,23,26)(H2,24,25,27,29)