2,2-dimethyl-5-pyrimidin-4-yl-4-[4-(quinolin-2-ylmethoxy)phenyl]furan-3-one

Systemtic Name: 2,2-dimethyl-5-pyrimidin-4-yl-4-[4-(quinolin-2-ylmethoxy)phenyl]furan-3-one Openeye Name: 2,2-dimethyl-5-pyrimidin-4-yl-4-[4-(2-quinolylmethoxy)phenyl]furan-3-one CAS Name: 2,2-dimethyl-5-(4-pyrimidinyl)-4-[4-(2-quinolinylmethoxy)phenyl]-3-furanone IUPAC Name: 2,2-dimethyl-5-pyrimidin-4-yl-4-[4-(quinolin-2-ylmethoxy)phenyl]furan-3-one Traditional Name: 2,2-dimethyl-5-(4-pyrimidyl)-4-[4-(2-quinolylmethoxy)phenyl]furan-3-one Formula: C26H21N3O3 MolecularWeight: 423.46324

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C(=C(O1)C2=NC=NC=C2)C3=CC=C(C=C3)OCC4=NC5=CC=CC=C5C=C4)C

Isomeric SMILES

CC1(C(=O)C(=C(O1)C2=NC=NC=C2)C3=CC=C(C=C3)OCC4=NC5=CC=CC=C5C=C4)C

InChI

InChI=1S/C26H21N3O3/c1-26(2)25(30)23(24(32-26)22-13-14-27-16-28-22)18-8-11-20(12-9-18)31-15-19-10-7-17-5-3-4-6-21(17)29-19/h3-14,16H,15H2,1-2H3