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

Systemtic Name: 1-[4-(6-morpholin-4-ylpyrimidin-4-yl)piperazin-1-yl]-3-(phenylsulfonyl)propan-1-one Openeye Name: 3-(benzenesulfonyl)-1-[4-(6-morpholinopyrimidin-4-yl)piperazin-1-yl]propan-1-one CAS Name: 3-(benzenesulfonyl)-1-[4-[6-(4-morpholinyl)-4-pyrimidinyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-(benzenesulfonyl)-1-[4-(6-morpholin-4-ylpyrimidin-4-yl)piperazin-1-yl]propan-1-one Traditional Name: 3-besyl-1-[4-(6-morpholinopyrimidin-4-yl)piperazino]propan-1-one Formula: C21H27N5O4S MolecularWeight: 445.53518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N5O4S/c27-21(6-15-31(28,29)18-4-2-1-3-5-18)26-9-7-24(8-10-26)19-16-20(23-17-22-19)25-11-13-30-14-12-25/h1-5,16-17H,6-15H2