4-bromanyl-N-(furan-2-ylmethylcarbamothioyl)-2-methyl-pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-N-(furan-2-ylmethylcarbamothioyl)-2-methyl-pyrazole-3-carboxamide Openeye Name: 4-bromo-N-(2-furylmethylcarbamothioyl)-2-methyl-pyrazole-3-carboxamide CAS Name: 4-bromo-N-[(2-furanylmethylamino)-sulfanylidenemethyl]-2-methyl-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-(furan-2-ylmethylcarbamothioyl)-2-methylpyrazole-3-carboxamide Traditional Name: 4-bromo-N-(2-furfurylthiocarbamoyl)-2-methyl-pyrazole-3-carboxamide Formula: C11H11BrN4O2S MolecularWeight: 343.19964

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)Br)C(=O)NC(=S)NCC2=CC=CO2

Isomeric SMILES

CN1C(=C(C=N1)Br)C(=O)NC(=S)NCC2=CC=CO2

InChI

InChI=1S/C11H11BrN4O2S/c1-16-9(8(12)6-14-16)10(17)15-11(19)13-5-7-3-2-4-18-7/h2-4,6H,5H2,1H3,(H2,13,15,17,19)