N-[[2-(3-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-2-(2-methylphenoxy)ethanamide

Systemtic Name: N-[[2-(3-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-2-(2-methylphenoxy)ethanamide Openeye Name: N-[[2-(3-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-2-(2-methylphenoxy)acetamide CAS Name: N-[[[2-(3-bromophenyl)-1,3-benzoxazol-5-yl]amino]-sulfanylidenemethyl]-2-(2-methylphenoxy)acetamide IUPAC Name: N-[[2-(3-bromophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-2-(2-methylphenoxy)acetamide Traditional Name: N-[[2-(3-bromophenyl)-1,3-benzoxazol-5-yl]thiocarbamoyl]-2-(2-methylphenoxy)acetamide Formula: C23H18BrN3O3S MolecularWeight: 496.37632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=CC(=CC=C4)Br

Isomeric SMILES

CC1=CC=CC=C1OCC(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C23H18BrN3O3S/c1-14-5-2-3-8-19(14)29-13-21(28)27-23(31)25-17-9-10-20-18(12-17)26-22(30-20)15-6-4-7-16(24)11-15/h2-12H,13H2,1H3,(H2,25,27,28,31)