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

Systemtic Name: 3-azanyl-5,6-dimethyl-2-[3-(4-quinolin-2-ylpiperazin-1-yl)propylsulfanyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-amino-5,6-dimethyl-2-[3-[4-(2-quinolyl)piperazin-1-yl]propylsulfanyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-amino-5,6-dimethyl-2-[3-[4-(2-quinolinyl)-1-piperazinyl]propylthio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-amino-5,6-dimethyl-2-[3-(4-quinolin-2-ylpiperazin-1-yl)propylsulfanyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-amino-5,6-dimethyl-2-[3-[4-(2-quinolyl)piperazino]propylthio]thieno[2,3-d]pyrimidin-4-one Formula: C24H28N6OS2 MolecularWeight: 480.64872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H28N6OS2/c1-16-17(2)33-22-21(16)23(31)30(25)24(27-22)32-15-5-10-28-11-13-29(14-12-28)20-9-8-18-6-3-4-7-19(18)26-20/h3-4,6-9H,5,10-15,25H2,1-2H3