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

Systemtic Name: 4-heptoxy-N-[[2-(oxolan-2-ylmethoxy)phenyl]carbamothioyl]benzamide Openeye Name: 4-heptoxy-N-[[2-(tetrahydrofuran-2-ylmethoxy)phenyl]carbamothioyl]benzamide CAS Name: 4-heptoxy-N-[[2-(2-oxolanylmethoxy)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-heptoxy-N-[[2-(oxolan-2-ylmethoxy)phenyl]carbamothioyl]benzamide Traditional Name: 4-heptoxy-N-[[2-(tetrahydrofurfuryloxy)phenyl]thiocarbamoyl]benzamide Formula: C26H34N2O4S MolecularWeight: 470.62416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2OCC3CCCO3

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2OCC3CCCO3

InChI

InChI=1S/C26H34N2O4S/c1-2-3-4-5-8-17-30-21-15-13-20(14-16-21)25(29)28-26(33)27-23-11-6-7-12-24(23)32-19-22-10-9-18-31-22/h6-7,11-16,22H,2-5,8-10,17-19H2,1H3,(H2,27,28,29,33)