3-(4-bromanyl-3-methyl-pyrazol-1-yl)-N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]propanamide

Systemtic Name: 3-(4-bromanyl-3-methyl-pyrazol-1-yl)-N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]propanamide Openeye Name: 3-(4-bromo-3-methyl-pyrazol-1-yl)-N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]propanamide CAS Name: 3-(4-bromo-3-methyl-1-pyrazolyl)-N-[1-[(3,4-diethoxyphenyl)methyl]-4-pyrazolyl]propanamide IUPAC Name: 3-(4-bromo-3-methylpyrazol-1-yl)-N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]propanamide Traditional Name: 3-(4-bromo-3-methyl-pyrazol-1-yl)-N-[1-(3,4-diethoxybenzyl)pyrazol-4-yl]propionamide 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)CCN3C=C(C(=N3)C)Br)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN2C=C(C=N2)NC(=O)CCN3C=C(C(=N3)C)Br)OCC

InChI

InChI=1S/C21H26BrN5O3/c1-4-29-19-7-6-16(10-20(19)30-5-2)12-27-13-17(11-23-27)24-21(28)8-9-26-14-18(22)15(3)25-26/h6-7,10-11,13-14H,4-5,8-9,12H2,1-3H3,(H,24,28)