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

Systemtic Name: 3-azanyl-5,6-dimethyl-2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-amino-5,6-dimethyl-2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-amino-5,6-dimethyl-2-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-amino-5,6-dimethyl-2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-amino-5,6-dimethyl-2-[[4-(2-pyrimidyl)piperazino]methyl]thieno[2,3-d]pyrimidin-4-one Formula: C17H21N7OS MolecularWeight: 371.45994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)CN3CCN(CC3)C4=NC=CC=N4)N)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)CN3CCN(CC3)C4=NC=CC=N4)N)C

InChI

InChI=1S/C17H21N7OS/c1-11-12(2)26-15-14(11)16(25)24(18)13(21-15)10-22-6-8-23(9-7-22)17-19-4-3-5-20-17/h3-5H,6-10,18H2,1-2H3