3-bromanyl-4-ethoxy-N-(heptylcarbamothioyl)benzamide

Systemtic Name: 3-bromanyl-4-ethoxy-N-(heptylcarbamothioyl)benzamide Openeye Name: 3-bromo-4-ethoxy-N-(heptylcarbamothioyl)benzamide CAS Name: 3-bromo-4-ethoxy-N-[(heptylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-ethoxy-N-(heptylcarbamothioyl)benzamide Traditional Name: 3-bromo-4-ethoxy-N-(heptylthiocarbamoyl)benzamide Formula: C17H25BrN2O2S MolecularWeight: 401.3616

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=S)NC(=O)C1=CC(=C(C=C1)OCC)Br

Isomeric SMILES

CCCCCCCNC(=S)NC(=O)C1=CC(=C(C=C1)OCC)Br

InChI

InChI=1S/C17H25BrN2O2S/c1-3-5-6-7-8-11-19-17(23)20-16(21)13-9-10-15(22-4-2)14(18)12-13/h9-10,12H,3-8,11H2,1-2H3,(H2,19,20,21,23)