N-[[3-(3-phenylpropoxy)phenyl]carbamothioyl]cyclohexanecarboxamide

Systemtic Name: N-[[3-(3-phenylpropoxy)phenyl]carbamothioyl]cyclohexanecarboxamide Openeye Name: N-[[3-(3-phenylpropoxy)phenyl]carbamothioyl]cyclohexanecarboxamide CAS Name: N-[[3-(3-phenylpropoxy)anilino]-sulfanylidenemethyl]cyclohexanecarboxamide IUPAC Name: N-[[3-(3-phenylpropoxy)phenyl]carbamothioyl]cyclohexanecarboxamide Traditional Name: N-[[3-(3-phenylpropoxy)phenyl]thiocarbamoyl]cyclohexanecarboxamide Formula: C23H28N2O2S MolecularWeight: 396.54562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC(=S)NC2=CC(=CC=C2)OCCCC3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)C(=O)NC(=S)NC2=CC(=CC=C2)OCCCC3=CC=CC=C3

InChI

InChI=1S/C23H28N2O2S/c26-22(19-12-5-2-6-13-19)25-23(28)24-20-14-7-15-21(17-20)27-16-8-11-18-9-3-1-4-10-18/h1,3-4,7,9-10,14-15,17,19H,2,5-6,8,11-13,16H2,(H2,24,25,26,28)