[6-(3,4-dimethoxyphenyl)pyridin-2-yl]-(2-piperazin-1-ylpyrimidin-4-yl)methanone

Systemtic Name: [6-(3,4-dimethoxyphenyl)pyridin-2-yl]-(2-piperazin-1-ylpyrimidin-4-yl)methanone Openeye Name: [6-(3,4-dimethoxyphenyl)-2-pyridyl]-(2-piperazin-1-ylpyrimidin-4-yl)methanone CAS Name: [6-(3,4-dimethoxyphenyl)-2-pyridinyl]-[2-(1-piperazinyl)-4-pyrimidinyl]methanone IUPAC Name: [6-(3,4-dimethoxyphenyl)pyridin-2-yl]-(2-piperazin-1-ylpyrimidin-4-yl)methanone Traditional Name: [6-(3,4-dimethoxyphenyl)-2-pyridyl]-(2-piperazinopyrimidin-4-yl)methanone Formula: C22H23N5O3 MolecularWeight: 405.44972

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=CC=C2)C(=O)C3=NC(=NC=C3)N4CCNCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=CC=C2)C(=O)C3=NC(=NC=C3)N4CCNCC4)OC

InChI

InChI=1S/C22H23N5O3/c1-29-19-7-6-15(14-20(19)30-2)16-4-3-5-17(25-16)21(28)18-8-9-24-22(26-18)27-12-10-23-11-13-27/h3-9,14,23H,10-13H2,1-2H3