4-bromanyl-N-(4-butylphenyl)-1,5-dimethyl-pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-N-(4-butylphenyl)-1,5-dimethyl-pyrazole-3-carboxamide Openeye Name: 4-bromo-N-(4-butylphenyl)-1,5-dimethyl-pyrazole-3-carboxamide CAS Name: 4-bromo-N-(4-butylphenyl)-1,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-(4-butylphenyl)-1,5-dimethylpyrazole-3-carboxamide Traditional Name: 4-bromo-N-(4-butylphenyl)-1,5-dimethyl-pyrazole-3-carboxamide Formula: C16H20BrN3O MolecularWeight: 350.2535

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2=NN(C(=C2Br)C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=NN(C(=C2Br)C)C

InChI

InChI=1S/C16H20BrN3O/c1-4-5-6-12-7-9-13(10-8-12)18-16(21)15-14(17)11(2)20(3)19-15/h7-10H,4-6H2,1-3H3,(H,18,21)