2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C18H20N6OS2 MolecularWeight: 400.521

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC=N2)SCC(=O)N3CCN(CC3)C4=NC=CC=N4)C

Isomeric SMILES

CC1=C(SC2=C1C(=NC=N2)SCC(=O)N3CCN(CC3)C4=NC=CC=N4)C

InChI

InChI=1S/C18H20N6OS2/c1-12-13(2)27-17-15(12)16(21-11-22-17)26-10-14(25)23-6-8-24(9-7-23)18-19-4-3-5-20-18/h3-5,11H,6-10H2,1-2H3