5-bromanyl-N-[1-(4-ethylphenyl)ethylcarbamothioyl]pyridine-3-carboxamide

Systemtic Name: 5-bromanyl-N-[1-(4-ethylphenyl)ethylcarbamothioyl]pyridine-3-carboxamide Openeye Name: 5-bromo-N-[1-(4-ethylphenyl)ethylcarbamothioyl]pyridine-3-carboxamide CAS Name: 5-bromo-N-[[1-(4-ethylphenyl)ethylamino]-sulfanylidenemethyl]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-[1-(4-ethylphenyl)ethylcarbamothioyl]pyridine-3-carboxamide Traditional Name: 5-bromo-N-[1-(4-ethylphenyl)ethylthiocarbamoyl]nicotinamide Formula: C17H18BrN3OS MolecularWeight: 392.31332

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C)NC(=S)NC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

CCC1=CC=C(C=C1)C(C)NC(=S)NC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C17H18BrN3OS/c1-3-12-4-6-13(7-5-12)11(2)20-17(23)21-16(22)14-8-15(18)10-19-9-14/h4-11H,3H2,1-2H3,(H2,20,21,22,23)