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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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