4-bromanyl-N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-2,5-dimethyl-pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-2,5-dimethyl-pyrazole-3-carboxamide Openeye Name: 4-bromo-N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-2,5-dimethyl-pyrazole-3-carboxamide CAS Name: 4-bromo-N-[1-[(3,4-diethoxyphenyl)methyl]-4-pyrazolyl]-2,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-2,5-dimethylpyrazole-3-carboxamide Traditional Name: 4-bromo-N-[1-(3,4-diethoxybenzyl)pyrazol-4-yl]-2,5-dimethyl-pyrazole-3-carboxamide Formula: C20H24BrN5O3 MolecularWeight: 462.34026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN2C=C(C=N2)NC(=O)C3=C(C(=NN3C)C)Br)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN2C=C(C=N2)NC(=O)C3=C(C(=NN3C)C)Br)OCC

InChI

InChI=1S/C20H24BrN5O3/c1-5-28-16-8-7-14(9-17(16)29-6-2)11-26-12-15(10-22-26)23-20(27)19-18(21)13(3)24-25(19)4/h7-10,12H,5-6,11H2,1-4H3,(H,23,27)