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

Systemtic Name: N-[(4-acetamidophenyl)carbamothioyl]-2-(2-bromanyl-4-methyl-phenoxy)ethanamide Openeye Name: N-[(4-acetamidophenyl)carbamothioyl]-2-(2-bromo-4-methyl-phenoxy)acetamide CAS Name: N-[(4-acetamidoanilino)-sulfanylidenemethyl]-2-(2-bromo-4-methylphenoxy)acetamide IUPAC Name: N-[(4-acetamidophenyl)carbamothioyl]-2-(2-bromo-4-methylphenoxy)acetamide Traditional Name: N-[(4-acetamidophenyl)thiocarbamoyl]-2-(2-bromo-4-methyl-phenoxy)acetamide Formula: C18H18BrN3O3S MolecularWeight: 436.32282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C)Br

InChI

InChI=1S/C18H18BrN3O3S/c1-11-3-8-16(15(19)9-11)25-10-17(24)22-18(26)21-14-6-4-13(5-7-14)20-12(2)23/h3-9H,10H2,1-2H3,(H,20,23)(H2,21,22,24,26)