5-bromanyl-N-(tert-butylcarbamothioyl)-2-phenethyloxy-benzamide

Systemtic Name: 5-bromanyl-N-(tert-butylcarbamothioyl)-2-phenethyloxy-benzamide Openeye Name: 5-bromo-N-(tert-butylcarbamothioyl)-2-phenethyloxy-benzamide CAS Name: 5-bromo-N-[(tert-butylamino)-sulfanylidenemethyl]-2-phenethyloxybenzamide IUPAC Name: 5-bromo-N-(tert-butylcarbamothioyl)-2-phenethyloxybenzamide Traditional Name: 5-bromo-N-(tert-butylthiocarbamoyl)-2-phenethyloxy-benzamide Formula: C20H23BrN2O2S MolecularWeight: 435.37782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NC(=O)C1=C(C=CC(=C1)Br)OCCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)NC(=S)NC(=O)C1=C(C=CC(=C1)Br)OCCC2=CC=CC=C2

InChI

InChI=1S/C20H23BrN2O2S/c1-20(2,3)23-19(26)22-18(24)16-13-15(21)9-10-17(16)25-12-11-14-7-5-4-6-8-14/h4-10,13H,11-12H2,1-3H3,(H2,22,23,24,26)