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

Systemtic Name: 3,5,6-trimethyl-2-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propylsulfanyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3,5,6-trimethyl-2-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propylsulfanyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3,5,6-trimethyl-2-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propylthio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3,5,6-trimethyl-2-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propylsulfanyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3,5,6-trimethyl-2-[3-[4-(2-pyrimidyl)piperazino]propylthio]thieno[2,3-d]pyrimidin-4-one Formula: C20H26N6OS2 MolecularWeight: 430.59004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCCCN3CCN(CC3)C4=NC=CC=N4)C)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCCCN3CCN(CC3)C4=NC=CC=N4)C)C

InChI

InChI=1S/C20H26N6OS2/c1-14-15(2)29-17-16(14)18(27)24(3)20(23-17)28-13-5-8-25-9-11-26(12-10-25)19-21-6-4-7-22-19/h4,6-7H,5,8-13H2,1-3H3