3-bromanyl-4-phenethyloxy-N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-phenethyloxy-N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]benzamide Openeye Name: 3-bromo-4-phenethyloxy-N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]benzamide CAS Name: 3-bromo-4-phenethyloxy-N-[[4-(3-phenylpropoxy)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-phenethyloxy-N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]benzamide Traditional Name: 3-bromo-4-phenethyloxy-N-[[4-(3-phenylpropoxy)phenyl]thiocarbamoyl]benzamide Formula: C31H29BrN2O3S MolecularWeight: 589.54256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=C(C=C3)OCCC4=CC=CC=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)CCCOC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=C(C=C3)OCCC4=CC=CC=C4)Br

InChI

InChI=1S/C31H29BrN2O3S/c32-28-22-25(13-18-29(28)37-21-19-24-10-5-2-6-11-24)30(35)34-31(38)33-26-14-16-27(17-15-26)36-20-7-12-23-8-3-1-4-9-23/h1-6,8-11,13-18,22H,7,12,19-21H2,(H2,33,34,35,38)