N-[(5-bromanyl-2-methoxy-phenyl)methyl]-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: N-[(5-bromanyl-2-methoxy-phenyl)methyl]-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-[(5-bromo-2-methoxy-phenyl)methyl]-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: N-[(5-bromo-2-methoxyphenyl)methyl]-1-phenyl-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-[(5-bromo-2-methoxyphenyl)methyl]-1-phenyl-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-(5-bromo-2-methoxy-benzyl)-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C22H19BrN4O2 MolecularWeight: 451.31586

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)CNC(=O)C2=C(N(N=C2)C3=CC=CC=C3)N4C=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)Br)CNC(=O)C2=C(N(N=C2)C3=CC=CC=C3)N4C=CC=C4

InChI

InChI=1S/C22H19BrN4O2/c1-29-20-10-9-17(23)13-16(20)14-24-21(28)19-15-25-27(18-7-3-2-4-8-18)22(19)26-11-5-6-12-26/h2-13,15H,14H2,1H3,(H,24,28)