3-bromanyl-N-(butan-2-ylcarbamothioyl)-4-butoxy-benzamide

Systemtic Name: 3-bromanyl-N-(butan-2-ylcarbamothioyl)-4-butoxy-benzamide Openeye Name: 3-bromo-4-butoxy-N-(sec-butylcarbamothioyl)benzamide CAS Name: 3-bromo-N-[(butan-2-ylamino)-sulfanylidenemethyl]-4-butoxybenzamide IUPAC Name: 3-bromo-N-(butan-2-ylcarbamothioyl)-4-butoxybenzamide Traditional Name: 3-bromo-4-butoxy-N-(sec-butylthiocarbamoyl)benzamide Formula: C16H23BrN2O2S MolecularWeight: 387.33502

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC(C)CC)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC(C)CC)Br

InChI

InChI=1S/C16H23BrN2O2S/c1-4-6-9-21-14-8-7-12(10-13(14)17)15(20)19-16(22)18-11(3)5-2/h7-8,10-11H,4-6,9H2,1-3H3,(H2,18,19,20,22)