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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC2=CN(N=C2)CC3=CC(=C(C=C3)OCC)OCC)Br

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC2=CN(N=C2)CC3=CC(=C(C=C3)OCC)OCC)Br

InChI

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