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

Systemtic Name: 4-pentoxy-N-[[2-(2-phenoxyethoxy)phenyl]carbamothioyl]benzamide Openeye Name: 4-pentoxy-N-[[2-(2-phenoxyethoxy)phenyl]carbamothioyl]benzamide CAS Name: 4-pentoxy-N-[[2-(2-phenoxyethoxy)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-pentoxy-N-[[2-(2-phenoxyethoxy)phenyl]carbamothioyl]benzamide Traditional Name: 4-amoxy-N-[[2-(2-phenoxyethoxy)phenyl]thiocarbamoyl]benzamide Formula: C27H30N2O4S MolecularWeight: 478.6031

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2OCCOC3=CC=CC=C3

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2OCCOC3=CC=CC=C3

InChI

InChI=1S/C27H30N2O4S/c1-2-3-9-18-31-23-16-14-21(15-17-23)26(30)29-27(34)28-24-12-7-8-13-25(24)33-20-19-32-22-10-5-4-6-11-22/h4-8,10-17H,2-3,9,18-20H2,1H3,(H2,28,29,30,34)