2-[3-[1-[(3,4-dimethoxypyridin-2-yl)methyl]pyrazol-3-yl]phenyl]pyrimidine

Systemtic Name: 2-[3-[1-[(3,4-dimethoxypyridin-2-yl)methyl]pyrazol-3-yl]phenyl]pyrimidine Openeye Name: 2-[3-[1-[(3,4-dimethoxy-2-pyridyl)methyl]pyrazol-3-yl]phenyl]pyrimidine CAS Name: 2-[3-[1-[(3,4-dimethoxy-2-pyridinyl)methyl]-3-pyrazolyl]phenyl]pyrimidine IUPAC Name: 2-[3-[1-[(3,4-dimethoxypyridin-2-yl)methyl]pyrazol-3-yl]phenyl]pyrimidine Traditional Name: 2-[3-[1-[(3,4-dimethoxy-2-pyridyl)methyl]pyrazol-3-yl]phenyl]pyrimidine Formula: C21H19N5O2 MolecularWeight: 373.40786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=NC=C1)CN2C=CC(=N2)C3=CC(=CC=C3)C4=NC=CC=N4)OC

Isomeric SMILES

COC1=C(C(=NC=C1)CN2C=CC(=N2)C3=CC(=CC=C3)C4=NC=CC=N4)OC

InChI

InChI=1S/C21H19N5O2/c1-27-19-7-11-22-18(20(19)28-2)14-26-12-8-17(25-26)15-5-3-6-16(13-15)21-23-9-4-10-24-21/h3-13H,14H2,1-2H3