4-bromanyl-3,5-dimethoxy-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide

Systemtic Name: 4-bromanyl-3,5-dimethoxy-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide Openeye Name: 4-bromo-3,5-dimethoxy-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide CAS Name: 4-bromo-3,5-dimethoxy-N-[2-[4-(1-pyrazolyl)phenyl]ethyl]benzamide IUPAC Name: 4-bromo-3,5-dimethoxy-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide Traditional Name: 4-bromo-3,5-dimethoxy-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide Formula: C20H20BrN3O3 MolecularWeight: 430.2951

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1Br)OC)C(=O)NCCC2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

COC1=CC(=CC(=C1Br)OC)C(=O)NCCC2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C20H20BrN3O3/c1-26-17-12-15(13-18(27-2)19(17)21)20(25)22-10-8-14-4-6-16(7-5-14)24-11-3-9-23-24/h3-7,9,11-13H,8,10H2,1-2H3,(H,22,25)