3-bromanyl-5-ethoxy-4-methoxy-N-[5-methyl-2-(phenylmethyl)pyrazol-3-yl]benzamide

Systemtic Name: 3-bromanyl-5-ethoxy-4-methoxy-N-[5-methyl-2-(phenylmethyl)pyrazol-3-yl]benzamide Openeye Name: N-(2-benzyl-5-methyl-pyrazol-3-yl)-3-bromo-5-ethoxy-4-methoxy-benzamide CAS Name: 3-bromo-5-ethoxy-4-methoxy-N-[5-methyl-2-(phenylmethyl)-3-pyrazolyl]benzamide IUPAC Name: N-(2-benzyl-5-methylpyrazol-3-yl)-3-bromo-5-ethoxy-4-methoxybenzamide Traditional Name: N-(2-benzyl-5-methyl-pyrazol-3-yl)-3-bromo-5-ethoxy-4-methoxy-benzamide Formula: C21H22BrN3O3 MolecularWeight: 444.32168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=O)NC2=CC(=NN2CC3=CC=CC=C3)C)Br)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=O)NC2=CC(=NN2CC3=CC=CC=C3)C)Br)OC

InChI

InChI=1S/C21H22BrN3O3/c1-4-28-18-12-16(11-17(22)20(18)27-3)21(26)23-19-10-14(2)24-25(19)13-15-8-6-5-7-9-15/h5-12H,4,13H2,1-3H3,(H,23,26)