2-hexoxy-N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]benzamide

Systemtic Name: 2-hexoxy-N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]benzamide Openeye Name: 2-hexoxy-N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]benzamide CAS Name: 2-hexoxy-N-[[4-(3-phenylpropoxy)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2-hexoxy-N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]benzamide Traditional Name: 2-hexoxy-N-[[4-(3-phenylpropoxy)phenyl]thiocarbamoyl]benzamide Formula: C29H34N2O3S MolecularWeight: 490.65686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)OCCCC3=CC=CC=C3

Isomeric SMILES

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)OCCCC3=CC=CC=C3

InChI

InChI=1S/C29H34N2O3S/c1-2-3-4-10-21-34-27-16-9-8-15-26(27)28(32)31-29(35)30-24-17-19-25(20-18-24)33-22-11-14-23-12-6-5-7-13-23/h5-9,12-13,15-20H,2-4,10-11,14,21-22H2,1H3,(H2,30,31,32,35)