5-bromanyl-N-[[2-(2-ethoxyethoxy)phenyl]carbamothioyl]-2-hexoxy-benzamide

Systemtic Name: 5-bromanyl-N-[[2-(2-ethoxyethoxy)phenyl]carbamothioyl]-2-hexoxy-benzamide Openeye Name: 5-bromo-N-[[2-(2-ethoxyethoxy)phenyl]carbamothioyl]-2-hexoxy-benzamide CAS Name: 5-bromo-N-[[2-(2-ethoxyethoxy)anilino]-sulfanylidenemethyl]-2-hexoxybenzamide IUPAC Name: 5-bromo-N-[[2-(2-ethoxyethoxy)phenyl]carbamothioyl]-2-hexoxybenzamide Traditional Name: 5-bromo-N-[[2-(2-ethoxyethoxy)phenyl]thiocarbamoyl]-2-hexoxy-benzamide Formula: C24H31BrN2O4S MolecularWeight: 523.48294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=CC=C2OCCOCC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=CC=C2OCCOCC

InChI

InChI=1S/C24H31BrN2O4S/c1-3-5-6-9-14-30-21-13-12-18(25)17-19(21)23(28)27-24(32)26-20-10-7-8-11-22(20)31-16-15-29-4-2/h7-8,10-13,17H,3-6,9,14-16H2,1-2H3,(H2,26,27,28,32)