4-bromanyl-2-methyl-N-phenethyl-pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-2-methyl-N-phenethyl-pyrazole-3-carboxamide Openeye Name: 4-bromo-2-methyl-N-phenethyl-pyrazole-3-carboxamide CAS Name: 4-bromo-2-methyl-N-phenethyl-3-pyrazolecarboxamide IUPAC Name: 4-bromo-2-methyl-N-phenethylpyrazole-3-carboxamide Traditional Name: 4-bromo-2-methyl-N-phenethyl-pyrazole-3-carboxamide Formula: C13H14BrN3O MolecularWeight: 308.17376

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)Br)C(=O)NCCC2=CC=CC=C2

Isomeric SMILES

CN1C(=C(C=N1)Br)C(=O)NCCC2=CC=CC=C2

InChI

InChI=1S/C13H14BrN3O/c1-17-12(11(14)9-16-17)13(18)15-8-7-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3,(H,15,18)