5-bromanyl-N-(oxolan-2-ylmethylcarbamothioyl)-2-phenethyloxy-benzamide

Systemtic Name: 5-bromanyl-N-(oxolan-2-ylmethylcarbamothioyl)-2-phenethyloxy-benzamide Openeye Name: 5-bromo-2-phenethyloxy-N-(tetrahydrofuran-2-ylmethylcarbamothioyl)benzamide CAS Name: 5-bromo-N-[(2-oxolanylmethylamino)-sulfanylidenemethyl]-2-phenethyloxybenzamide IUPAC Name: 5-bromo-N-(oxolan-2-ylmethylcarbamothioyl)-2-phenethyloxybenzamide Traditional Name: 5-bromo-2-phenethyloxy-N-(tetrahydrofurfurylthiocarbamoyl)benzamide Formula: C21H23BrN2O3S MolecularWeight: 463.38792

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=S)NC(=O)C2=C(C=CC(=C2)Br)OCCC3=CC=CC=C3

Isomeric SMILES

C1CC(OC1)CNC(=S)NC(=O)C2=C(C=CC(=C2)Br)OCCC3=CC=CC=C3

InChI

InChI=1S/C21H23BrN2O3S/c22-16-8-9-19(27-12-10-15-5-2-1-3-6-15)18(13-16)20(25)24-21(28)23-14-17-7-4-11-26-17/h1-3,5-6,8-9,13,17H,4,7,10-12,14H2,(H2,23,24,25,28)