5-bromanyl-N-[[2-(4-chlorophenyl)ethanoylamino]carbamothioyl]-2-methoxy-benzamide

Systemtic Name: 5-bromanyl-N-[[2-(4-chlorophenyl)ethanoylamino]carbamothioyl]-2-methoxy-benzamide Openeye Name: 5-bromo-N-[[[2-(4-chlorophenyl)acetyl]amino]carbamothioyl]-2-methoxy-benzamide CAS Name: 5-bromo-N-[[[2-(4-chlorophenyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-methoxybenzamide IUPAC Name: 5-bromo-N-[[[2-(4-chlorophenyl)acetyl]amino]carbamothioyl]-2-methoxybenzamide Traditional Name: 5-bromo-N-[[[2-(4-chlorophenyl)acetyl]amino]thiocarbamoyl]-2-methoxy-benzamide Formula: C17H15BrClN3O3S MolecularWeight: 456.7413

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NNC(=O)CC2=CC=C(C=C2)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NNC(=O)CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H15BrClN3O3S/c1-25-14-7-4-11(18)9-13(14)16(24)20-17(26)22-21-15(23)8-10-2-5-12(19)6-3-10/h2-7,9H,8H2,1H3,(H,21,23)(H2,20,22,24,26)