N-[[3-(2-ethoxyethoxy)phenyl]carbamothioyl]-4-heptoxy-benzamide

Systemtic Name: N-[[3-(2-ethoxyethoxy)phenyl]carbamothioyl]-4-heptoxy-benzamide Openeye Name: N-[[3-(2-ethoxyethoxy)phenyl]carbamothioyl]-4-heptoxy-benzamide CAS Name: N-[[3-(2-ethoxyethoxy)anilino]-sulfanylidenemethyl]-4-heptoxybenzamide IUPAC Name: N-[[3-(2-ethoxyethoxy)phenyl]carbamothioyl]-4-heptoxybenzamide Traditional Name: N-[[3-(2-ethoxyethoxy)phenyl]thiocarbamoyl]-4-heptoxy-benzamide Formula: C25H34N2O4S MolecularWeight: 458.61346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)OCCOCC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)OCCOCC

InChI

InChI=1S/C25H34N2O4S/c1-3-5-6-7-8-16-30-22-14-12-20(13-15-22)24(28)27-25(32)26-21-10-9-11-23(19-21)31-18-17-29-4-2/h9-15,19H,3-8,16-18H2,1-2H3,(H2,26,27,28,32)