5-bromanyl-N-(butan-2-ylcarbamothioyl)-2-phenethyloxy-benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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