4-[[1-[(4-bromanylphenoxy)methyl]pyrazol-3-yl]carbonylamino]-1-ethyl-pyrazole-3-carboxamide

Systemtic Name: 4-[[1-[(4-bromanylphenoxy)methyl]pyrazol-3-yl]carbonylamino]-1-ethyl-pyrazole-3-carboxamide Openeye Name: 4-[[1-[(4-bromophenoxy)methyl]pyrazole-3-carbonyl]amino]-1-ethyl-pyrazole-3-carboxamide CAS Name: 4-[[[1-[(4-bromophenoxy)methyl]-3-pyrazolyl]-oxomethyl]amino]-1-ethyl-3-pyrazolecarboxamide IUPAC Name: 4-[[1-[(4-bromophenoxy)methyl]pyrazole-3-carbonyl]amino]-1-ethylpyrazole-3-carboxamide Traditional Name: 4-[[1-[(4-bromophenoxy)methyl]pyrazole-3-carbonyl]amino]-1-ethyl-pyrazole-3-carboxamide Formula: C17H17BrN6O3 MolecularWeight: 433.25928

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)N)NC(=O)C2=NN(C=C2)COC3=CC=C(C=C3)Br

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)N)NC(=O)C2=NN(C=C2)COC3=CC=C(C=C3)Br

InChI

InChI=1S/C17H17BrN6O3/c1-2-23-9-14(15(22-23)16(19)25)20-17(26)13-7-8-24(21-13)10-27-12-5-3-11(18)4-6-12/h3-9H,2,10H2,1H3,(H2,19,25)(H,20,26)