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

Systemtic Name: 2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)-N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]ethanamide Openeye Name: 2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]acetamide CAS Name: 2-(4-bromo-3,5-dimethyl-1-pyrazolyl)-N-[1-[(3,4-diethoxyphenyl)methyl]-4-pyrazolyl]acetamide IUPAC Name: 2-(4-bromo-3,5-dimethylpyrazol-1-yl)-N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]acetamide Traditional Name: 2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)-N-[1-(3,4-diethoxybenzyl)pyrazol-4-yl]acetamide Formula: C21H26BrN5O3 MolecularWeight: 476.36684

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN2C=C(C=N2)NC(=O)CN3C(=C(C(=N3)C)Br)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN2C=C(C=N2)NC(=O)CN3C(=C(C(=N3)C)Br)C)OCC

InChI

InChI=1S/C21H26BrN5O3/c1-5-29-18-8-7-16(9-19(18)30-6-2)11-26-12-17(10-23-26)24-20(28)13-27-15(4)21(22)14(3)25-27/h7-10,12H,5-6,11,13H2,1-4H3,(H,24,28)