N-[[4-(oxolan-2-ylmethoxy)phenyl]carbamothioyl]-3-propoxy-benzamide

Systemtic Name: N-[[4-(oxolan-2-ylmethoxy)phenyl]carbamothioyl]-3-propoxy-benzamide Openeye Name: 3-propoxy-N-[[4-(tetrahydrofuran-2-ylmethoxy)phenyl]carbamothioyl]benzamide CAS Name: N-[[4-(2-oxolanylmethoxy)anilino]-sulfanylidenemethyl]-3-propoxybenzamide IUPAC Name: N-[[4-(oxolan-2-ylmethoxy)phenyl]carbamothioyl]-3-propoxybenzamide Traditional Name: 3-propoxy-N-[[4-(tetrahydrofurfuryloxy)phenyl]thiocarbamoyl]benzamide Formula: C22H26N2O4S MolecularWeight: 414.51784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)OCC3CCCO3

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)OCC3CCCO3

InChI

InChI=1S/C22H26N2O4S/c1-2-12-26-19-6-3-5-16(14-19)21(25)24-22(29)23-17-8-10-18(11-9-17)28-15-20-7-4-13-27-20/h3,5-6,8-11,14,20H,2,4,7,12-13,15H2,1H3,(H2,23,24,25,29)