3-bromanyl-N-[(4-ethanoylphenyl)carbamothioyl]-4-(2-methylpropoxy)benzamide

Systemtic Name: 3-bromanyl-N-[(4-ethanoylphenyl)carbamothioyl]-4-(2-methylpropoxy)benzamide Openeye Name: N-[(4-acetylphenyl)carbamothioyl]-3-bromo-4-isobutoxy-benzamide CAS Name: N-[(4-acetylanilino)-sulfanylidenemethyl]-3-bromo-4-(2-methylpropoxy)benzamide IUPAC Name: N-[(4-acetylphenyl)carbamothioyl]-3-bromo-4-(2-methylpropoxy)benzamide Traditional Name: N-[(4-acetylphenyl)thiocarbamoyl]-3-bromo-4-isobutoxy-benzamide Formula: C20H21BrN2O3S MolecularWeight: 449.36134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)C)Br

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)C)Br

InChI

InChI=1S/C20H21BrN2O3S/c1-12(2)11-26-18-9-6-15(10-17(18)21)19(25)23-20(27)22-16-7-4-14(5-8-16)13(3)24/h4-10,12H,11H2,1-3H3,(H2,22,23,25,27)