N-[[4-(2-cyclohexylethoxy)phenyl]carbamothioyl]-2-pentoxy-benzamide

Systemtic Name: N-[[4-(2-cyclohexylethoxy)phenyl]carbamothioyl]-2-pentoxy-benzamide Openeye Name: N-[[4-(2-cyclohexylethoxy)phenyl]carbamothioyl]-2-pentoxy-benzamide CAS Name: N-[[4-(2-cyclohexylethoxy)anilino]-sulfanylidenemethyl]-2-pentoxybenzamide IUPAC Name: N-[[4-(2-cyclohexylethoxy)phenyl]carbamothioyl]-2-pentoxybenzamide Traditional Name: 2-amoxy-N-[[4-(2-cyclohexylethoxy)phenyl]thiocarbamoyl]benzamide Formula: C27H36N2O3S MolecularWeight: 468.65134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)OCCC3CCCCC3

Isomeric SMILES

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)OCCC3CCCCC3

InChI

InChI=1S/C27H36N2O3S/c1-2-3-9-19-32-25-13-8-7-12-24(25)26(30)29-27(33)28-22-14-16-23(17-15-22)31-20-18-21-10-5-4-6-11-21/h7-8,12-17,21H,2-6,9-11,18-20H2,1H3,(H2,28,29,30,33)