4-[[3-[(2-bromanylphenoxy)methyl]-4-methoxy-phenyl]carbonylamino]-2-methyl-pyrazole-3-carboxamide

Systemtic Name: 4-[[3-[(2-bromanylphenoxy)methyl]-4-methoxy-phenyl]carbonylamino]-2-methyl-pyrazole-3-carboxamide Openeye Name: 4-[[3-[(2-bromophenoxy)methyl]-4-methoxy-benzoyl]amino]-2-methyl-pyrazole-3-carboxamide CAS Name: 4-[[[3-[(2-bromophenoxy)methyl]-4-methoxyphenyl]-oxomethyl]amino]-2-methyl-3-pyrazolecarboxamide IUPAC Name: 4-[[3-[(2-bromophenoxy)methyl]-4-methoxybenzoyl]amino]-2-methylpyrazole-3-carboxamide Traditional Name: 4-[[3-[(2-bromophenoxy)methyl]-4-methoxy-benzoyl]amino]-2-methyl-pyrazole-3-carboxamide Formula: C20H19BrN4O4 MolecularWeight: 459.29326

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)NC(=O)C2=CC(=C(C=C2)OC)COC3=CC=CC=C3Br)C(=O)N

Isomeric SMILES

CN1C(=C(C=N1)NC(=O)C2=CC(=C(C=C2)OC)COC3=CC=CC=C3Br)C(=O)N

InChI

InChI=1S/C20H19BrN4O4/c1-25-18(19(22)26)15(10-23-25)24-20(27)12-7-8-16(28-2)13(9-12)11-29-17-6-4-3-5-14(17)21/h3-10H,11H2,1-2H3,(H2,22,26)(H,24,27)