4-bromanyl-N-(4-butylphenyl)-1-methyl-pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-N-(4-butylphenyl)-1-methyl-pyrazole-3-carboxamide Openeye Name: 4-bromo-N-(4-butylphenyl)-1-methyl-pyrazole-3-carboxamide CAS Name: 4-bromo-N-(4-butylphenyl)-1-methyl-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-(4-butylphenyl)-1-methylpyrazole-3-carboxamide Traditional Name: 4-bromo-N-(4-butylphenyl)-1-methyl-pyrazole-3-carboxamide Formula: C15H18BrN3O MolecularWeight: 336.22692

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18BrN3O/c1-3-4-5-11-6-8-12(9-7-11)17-15(20)14-13(16)10-19(2)18-14/h6-10H,3-5H2,1-2H3,(H,17,20)