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

Systemtic Name: N-[[3-(oxolan-2-ylmethoxy)phenyl]carbamothioyl]-2-phenethyloxy-benzamide Openeye Name: 2-phenethyloxy-N-[[3-(tetrahydrofuran-2-ylmethoxy)phenyl]carbamothioyl]benzamide CAS Name: N-[[3-(2-oxolanylmethoxy)anilino]-sulfanylidenemethyl]-2-phenethyloxybenzamide IUPAC Name: N-[[3-(oxolan-2-ylmethoxy)phenyl]carbamothioyl]-2-phenethyloxybenzamide Traditional Name: 2-phenethyloxy-N-[[3-(tetrahydrofurfuryloxy)phenyl]thiocarbamoyl]benzamide Formula: C27H28N2O4S MolecularWeight: 476.58722

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)COC2=CC=CC(=C2)NC(=S)NC(=O)C3=CC=CC=C3OCCC4=CC=CC=C4

Isomeric SMILES

C1CC(OC1)COC2=CC=CC(=C2)NC(=S)NC(=O)C3=CC=CC=C3OCCC4=CC=CC=C4

InChI

InChI=1S/C27H28N2O4S/c30-26(24-13-4-5-14-25(24)32-17-15-20-8-2-1-3-9-20)29-27(34)28-21-10-6-11-22(18-21)33-19-23-12-7-16-31-23/h1-6,8-11,13-14,18,23H,7,12,15-17,19H2,(H2,28,29,30,34)