3-bromanyl-N-(2-diethylaminoethylcarbamothioyl)-4-ethoxy-benzamide

Systemtic Name: 3-bromanyl-N-(2-diethylaminoethylcarbamothioyl)-4-ethoxy-benzamide Openeye Name: 3-bromo-N-(2-diethylaminoethylcarbamothioyl)-4-ethoxy-benzamide CAS Name: 3-bromo-N-[(2-diethylaminoethylamino)-sulfanylidenemethyl]-4-ethoxybenzamide IUPAC Name: 3-bromo-N-(2-diethylaminoethylcarbamothioyl)-4-ethoxybenzamide Traditional Name: 3-bromo-N-(2-diethylaminoethylthiocarbamoyl)-4-ethoxy-benzamide Formula: C16H24BrN3O2S MolecularWeight: 402.34966

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=S)NC(=O)C1=CC(=C(C=C1)OCC)Br

Isomeric SMILES

CCN(CC)CCNC(=S)NC(=O)C1=CC(=C(C=C1)OCC)Br

InChI

InChI=1S/C16H24BrN3O2S/c1-4-20(5-2)10-9-18-16(23)19-15(21)12-7-8-14(22-6-3)13(17)11-12/h7-8,11H,4-6,9-10H2,1-3H3,(H2,18,19,21,23)