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

Systemtic Name: 4-[[3-[(2-bromanylphenoxy)methyl]-4-methoxy-phenyl]carbonylamino]-N,1-dimethyl-pyrazole-3-carboxamide Openeye Name: 4-[[3-[(2-bromophenoxy)methyl]-4-methoxy-benzoyl]amino]-N,1-dimethyl-pyrazole-3-carboxamide CAS Name: 4-[[[3-[(2-bromophenoxy)methyl]-4-methoxyphenyl]-oxomethyl]amino]-N,1-dimethyl-3-pyrazolecarboxamide IUPAC Name: 4-[[3-[(2-bromophenoxy)methyl]-4-methoxybenzoyl]amino]-N,1-dimethylpyrazole-3-carboxamide Traditional Name: 4-[[3-[(2-bromophenoxy)methyl]-4-methoxy-benzoyl]amino]-N,1-dimethyl-pyrazole-3-carboxamide Formula: C21H21BrN4O4 MolecularWeight: 473.31984

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=NN(C=C1NC(=O)C2=CC(=C(C=C2)OC)COC3=CC=CC=C3Br)C

Isomeric SMILES

CNC(=O)C1=NN(C=C1NC(=O)C2=CC(=C(C=C2)OC)COC3=CC=CC=C3Br)C

InChI

InChI=1S/C21H21BrN4O4/c1-23-21(28)19-16(11-26(2)25-19)24-20(27)13-8-9-17(29-3)14(10-13)12-30-18-7-5-4-6-15(18)22/h4-11H,12H2,1-3H3,(H,23,28)(H,24,27)