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

Systemtic Name: 4-tert-butyl-N-[[3-(oxolan-2-ylmethoxy)phenyl]carbamothioyl]benzamide Openeye Name: 4-tert-butyl-N-[[3-(tetrahydrofuran-2-ylmethoxy)phenyl]carbamothioyl]benzamide CAS Name: 4-tert-butyl-N-[[3-(2-oxolanylmethoxy)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-tert-butyl-N-[[3-(oxolan-2-ylmethoxy)phenyl]carbamothioyl]benzamide Traditional Name: 4-tert-butyl-N-[[3-(tetrahydrofurfuryloxy)phenyl]thiocarbamoyl]benzamide Formula: C23H28N2O3S MolecularWeight: 412.54502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N2O3S/c1-23(2,3)17-11-9-16(10-12-17)21(26)25-22(29)24-18-6-4-7-19(14-18)28-15-20-8-5-13-27-20/h4,6-7,9-12,14,20H,5,8,13,15H2,1-3H3,(H2,24,25,26,29)