(3,4-dimethoxyphenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (3,4-dimethoxyphenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (3,4-dimethoxyphenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: (3,4-dimethoxyphenyl)-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (3,4-dimethoxyphenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (3,4-dimethoxyphenyl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C17H20N4O3 MolecularWeight: 328.3657

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=NC=CC=N3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=NC=CC=N3)OC

InChI

InChI=1S/C17H20N4O3/c1-23-14-5-4-13(12-15(14)24-2)16(22)20-8-10-21(11-9-20)17-18-6-3-7-19-17/h3-7,12H,8-11H2,1-2H3