2-(4-methyl-6-morpholin-4-yl-pyrimidin-2-yl)sulfanyl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-(4-methyl-6-morpholin-4-yl-pyrimidin-2-yl)sulfanyl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-(4-methyl-6-morpholino-pyrimidin-2-yl)sulfanyl-1-[4-(2-pyridyl)piperazin-1-yl]ethanone CAS Name: 2-[[4-methyl-6-(4-morpholinyl)-2-pyrimidinyl]thio]-1-[4-(2-pyridinyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)sulfanyl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[(4-methyl-6-morpholino-pyrimidin-2-yl)thio]-1-[4-(2-pyridyl)piperazino]ethanone Formula: C20H26N6O2S MolecularWeight: 414.52444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)N2CCN(CC2)C3=CC=CC=N3)N4CCOCC4

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)N2CCN(CC2)C3=CC=CC=N3)N4CCOCC4

InChI

InChI=1S/C20H26N6O2S/c1-16-14-18(25-10-12-28-13-11-25)23-20(22-16)29-15-19(27)26-8-6-24(7-9-26)17-4-2-3-5-21-17/h2-5,14H,6-13,15H2,1H3