4-[[3-[(2-bromanylphenoxy)methyl]-4-methoxy-phenyl]carbonylamino]-1-ethyl-N-(2-methylpropyl)pyrazole-3-carboxamide

Systemtic Name: 4-[[3-[(2-bromanylphenoxy)methyl]-4-methoxy-phenyl]carbonylamino]-1-ethyl-N-(2-methylpropyl)pyrazole-3-carboxamide Openeye Name: 4-[[3-[(2-bromophenoxy)methyl]-4-methoxy-benzoyl]amino]-1-ethyl-N-isobutyl-pyrazole-3-carboxamide CAS Name: 4-[[[3-[(2-bromophenoxy)methyl]-4-methoxyphenyl]-oxomethyl]amino]-1-ethyl-N-(2-methylpropyl)-3-pyrazolecarboxamide IUPAC Name: 4-[[3-[(2-bromophenoxy)methyl]-4-methoxybenzoyl]amino]-1-ethyl-N-(2-methylpropyl)pyrazole-3-carboxamide Traditional Name: 4-[[3-[(2-bromophenoxy)methyl]-4-methoxy-benzoyl]amino]-1-ethyl-N-isobutyl-pyrazole-3-carboxamide Formula: C25H29BrN4O4 MolecularWeight: 529.42616

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NCC(C)C)NC(=O)C2=CC(=C(C=C2)OC)COC3=CC=CC=C3Br

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NCC(C)C)NC(=O)C2=CC(=C(C=C2)OC)COC3=CC=CC=C3Br

InChI

InChI=1S/C25H29BrN4O4/c1-5-30-14-20(23(29-30)25(32)27-13-16(2)3)28-24(31)17-10-11-21(33-4)18(12-17)15-34-22-9-7-6-8-19(22)26/h6-12,14,16H,5,13,15H2,1-4H3,(H,27,32)(H,28,31)