(2,5-dimethoxyphenyl)-[4-(3-pyrimidin-4-ylpiperidin-1-yl)carbonylphenyl]methanone

Systemtic Name: (2,5-dimethoxyphenyl)-[4-(3-pyrimidin-4-ylpiperidin-1-yl)carbonylphenyl]methanone Openeye Name: (2,5-dimethoxyphenyl)-[4-(3-pyrimidin-4-ylpiperidine-1-carbonyl)phenyl]methanone CAS Name: (2,5-dimethoxyphenyl)-[4-[oxo-[3-(4-pyrimidinyl)-1-piperidinyl]methyl]phenyl]methanone IUPAC Name: (2,5-dimethoxyphenyl)-[4-(3-pyrimidin-4-ylpiperidine-1-carbonyl)phenyl]methanone Traditional Name: (2,5-dimethoxyphenyl)-[4-[3-(4-pyrimidyl)piperidine-1-carbonyl]phenyl]methanone Formula: C25H25N3O4 MolecularWeight: 431.4837

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(=O)C2=CC=C(C=C2)C(=O)N3CCCC(C3)C4=NC=NC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C(=O)C2=CC=C(C=C2)C(=O)N3CCCC(C3)C4=NC=NC=C4

InChI

InChI=1S/C25H25N3O4/c1-31-20-9-10-23(32-2)21(14-20)24(29)17-5-7-18(8-6-17)25(30)28-13-3-4-19(15-28)22-11-12-26-16-27-22/h5-12,14,16,19H,3-4,13,15H2,1-2H3