1-[(4-bromanylpyrazol-1-yl)methyl]-N-[1-(2,5-dimethoxyphenyl)ethyl]pyrazole-3-carboxamide

Systemtic Name: 1-[(4-bromanylpyrazol-1-yl)methyl]-N-[1-(2,5-dimethoxyphenyl)ethyl]pyrazole-3-carboxamide Openeye Name: 1-[(4-bromopyrazol-1-yl)methyl]-N-[1-(2,5-dimethoxyphenyl)ethyl]pyrazole-3-carboxamide CAS Name: 1-[(4-bromo-1-pyrazolyl)methyl]-N-[1-(2,5-dimethoxyphenyl)ethyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromopyrazol-1-yl)methyl]-N-[1-(2,5-dimethoxyphenyl)ethyl]pyrazole-3-carboxamide Traditional Name: 1-[(4-bromopyrazol-1-yl)methyl]-N-[1-(2,5-dimethoxyphenyl)ethyl]pyrazole-3-carboxamide Formula: C18H20BrN5O3 MolecularWeight: 434.2871

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC(=C1)OC)OC)NC(=O)C2=NN(C=C2)CN3C=C(C=N3)Br

Isomeric SMILES

CC(C1=C(C=CC(=C1)OC)OC)NC(=O)C2=NN(C=C2)CN3C=C(C=N3)Br

InChI

InChI=1S/C18H20BrN5O3/c1-12(15-8-14(26-2)4-5-17(15)27-3)21-18(25)16-6-7-23(22-16)11-24-10-13(19)9-20-24/h4-10,12H,11H2,1-3H3,(H,21,25)