5-bromanyl-N-(furan-2-ylmethylcarbamothioyl)-2-phenethyloxy-benzamide

Systemtic Name: 5-bromanyl-N-(furan-2-ylmethylcarbamothioyl)-2-phenethyloxy-benzamide Openeye Name: 5-bromo-N-(2-furylmethylcarbamothioyl)-2-phenethyloxy-benzamide CAS Name: 5-bromo-N-[(2-furanylmethylamino)-sulfanylidenemethyl]-2-phenethyloxybenzamide IUPAC Name: 5-bromo-N-(furan-2-ylmethylcarbamothioyl)-2-phenethyloxybenzamide Traditional Name: 5-bromo-N-(2-furfurylthiocarbamoyl)-2-phenethyloxy-benzamide Formula: C21H19BrN2O3S MolecularWeight: 459.35616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)Br)C(=O)NC(=S)NCC3=CC=CO3

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)Br)C(=O)NC(=S)NCC3=CC=CO3

InChI

InChI=1S/C21H19BrN2O3S/c22-16-8-9-19(27-12-10-15-5-2-1-3-6-15)18(13-16)20(25)24-21(28)23-14-17-7-4-11-26-17/h1-9,11,13H,10,12,14H2,(H2,23,24,25,28)