N-[(3-bromanyl-4-methoxy-phenyl)carbamothioyl]-3-phenylmethoxy-benzamide

Systemtic Name: N-[(3-bromanyl-4-methoxy-phenyl)carbamothioyl]-3-phenylmethoxy-benzamide Openeye Name: 3-benzyloxy-N-[(3-bromo-4-methoxy-phenyl)carbamothioyl]benzamide CAS Name: N-[(3-bromo-4-methoxyanilino)-sulfanylidenemethyl]-3-phenylmethoxybenzamide IUPAC Name: N-[(3-bromo-4-methoxyphenyl)carbamothioyl]-3-phenylmethoxybenzamide Traditional Name: 3-benzoxy-N-[(3-bromo-4-methoxy-phenyl)thiocarbamoyl]benzamide Formula: C22H19BrN2O3S MolecularWeight: 471.36686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCC3=CC=CC=C3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCC3=CC=CC=C3)Br

InChI

InChI=1S/C22H19BrN2O3S/c1-27-20-11-10-17(13-19(20)23)24-22(29)25-21(26)16-8-5-9-18(12-16)28-14-15-6-3-2-4-7-15/h2-13H,14H2,1H3,(H2,24,25,26,29)