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

Systemtic Name: 1-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(2-ethoxyphenyl)pyrazole-3-carboxamide Openeye Name: 1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(2-ethoxyphenyl)pyrazole-3-carboxamide CAS Name: 1-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-N-(2-ethoxyphenyl)-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(2-ethoxyphenyl)pyrazole-3-carboxamide Traditional Name: 1-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-o-phenetyl-pyrazole-3-carboxamide Formula: C18H20BrN5O2 MolecularWeight: 418.2877

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C2=NN(C=C2)CN3C(=C(C(=N3)C)Br)C

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)C2=NN(C=C2)CN3C(=C(C(=N3)C)Br)C

InChI

InChI=1S/C18H20BrN5O2/c1-4-26-16-8-6-5-7-14(16)20-18(25)15-9-10-23(22-15)11-24-13(3)17(19)12(2)21-24/h5-10H,4,11H2,1-3H3,(H,20,25)