4-bromanyl-1-ethyl-N-(phenylmethyl)pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-1-ethyl-N-(phenylmethyl)pyrazole-3-carboxamide Openeye Name: N-benzyl-4-bromo-1-ethyl-pyrazole-3-carboxamide CAS Name: 4-bromo-1-ethyl-N-(phenylmethyl)-3-pyrazolecarboxamide IUPAC Name: N-benzyl-4-bromo-1-ethylpyrazole-3-carboxamide Traditional Name: N-benzyl-4-bromo-1-ethyl-pyrazole-3-carboxamide Formula: C13H14BrN3O MolecularWeight: 308.17376

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NCC2=CC=CC=C2)Br

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NCC2=CC=CC=C2)Br

InChI

InChI=1S/C13H14BrN3O/c1-2-17-9-11(14)12(16-17)13(18)15-8-10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3,(H,15,18)