6-ethyl-3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 6-ethyl-3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-ethyl-3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 6-ethyl-3-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 6-ethyl-3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-ethyl-3-[[4-(2-pyrimidyl)piperazino]methyl]thieno[2,3-d]pyrimidin-4-one Formula: C17H20N6OS MolecularWeight: 356.4453

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=CN(C2=O)CN3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CCC1=CC2=C(S1)N=CN(C2=O)CN3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C17H20N6OS/c1-2-13-10-14-15(25-13)20-11-23(16(14)24)12-21-6-8-22(9-7-21)17-18-4-3-5-19-17/h3-5,10-11H,2,6-9,12H2,1H3