5,6-dimethyl-2-[3-(4-quinolin-2-ylpiperazin-1-yl)propylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-[3-(4-quinolin-2-ylpiperazin-1-yl)propylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-[3-[4-(2-quinolyl)piperazin-1-yl]propylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[3-[4-(2-quinolinyl)-1-piperazinyl]propylthio]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5,6-dimethyl-2-[3-(4-quinolin-2-ylpiperazin-1-yl)propylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5,6-dimethyl-2-[3-[4-(2-quinolyl)piperazino]propylthio]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C24H27N5OS2 MolecularWeight: 465.63408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)SCCCN3CCN(CC3)C4=NC5=CC=CC=C5C=C4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)SCCCN3CCN(CC3)C4=NC5=CC=CC=C5C=C4)C

InChI

InChI=1S/C24H27N5OS2/c1-16-17(2)32-23-21(16)22(30)26-24(27-23)31-15-5-10-28-11-13-29(14-12-28)20-9-8-18-6-3-4-7-19(18)25-20/h3-4,6-9H,5,10-15H2,1-2H3,(H,26,27,30)