1-[4-(6-morpholin-4-ylpyrimidin-4-yl)piperazin-1-yl]-3-phenylsulfanyl-propan-1-one

Systemtic Name: 1-[4-(6-morpholin-4-ylpyrimidin-4-yl)piperazin-1-yl]-3-phenylsulfanyl-propan-1-one Openeye Name: 1-[4-(6-morpholinopyrimidin-4-yl)piperazin-1-yl]-3-phenylsulfanyl-propan-1-one CAS Name: 1-[4-[6-(4-morpholinyl)-4-pyrimidinyl]-1-piperazinyl]-3-(phenylthio)-1-propanone IUPAC Name: 1-[4-(6-morpholin-4-ylpyrimidin-4-yl)piperazin-1-yl]-3-phenylsulfanylpropan-1-one Traditional Name: 1-[4-(6-morpholinopyrimidin-4-yl)piperazino]-3-(phenylthio)propan-1-one Formula: C21H27N5O2S MolecularWeight: 413.53638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=NC=N2)N3CCOCC3)C(=O)CCSC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC(=NC=N2)N3CCOCC3)C(=O)CCSC4=CC=CC=C4

InChI

InChI=1S/C21H27N5O2S/c27-21(6-15-29-18-4-2-1-3-5-18)26-9-7-24(8-10-26)19-16-20(23-17-22-19)25-11-13-28-14-12-25/h1-5,16-17H,6-15H2