5,6-dimethyl-2-[(4-piperidin-1-ylsulfonylpiperazin-1-yl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-[(4-piperidin-1-ylsulfonylpiperazin-1-yl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-[[4-(1-piperidylsulfonyl)piperazin-1-yl]methyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[[4-(1-piperidinylsulfonyl)-1-piperazinyl]methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5,6-dimethyl-2-[(4-piperidin-1-ylsulfonylpiperazin-1-yl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5,6-dimethyl-2-[(4-piperidinosulfonylpiperazino)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C18H27N5O3S2 MolecularWeight: 425.56868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CN3CCN(CC3)S(=O)(=O)N4CCCCC4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CN3CCN(CC3)S(=O)(=O)N4CCCCC4)C

InChI

InChI=1S/C18H27N5O3S2/c1-13-14(2)27-18-16(13)17(24)19-15(20-18)12-21-8-10-23(11-9-21)28(25,26)22-6-4-3-5-7-22/h3-12H2,1-2H3,(H,19,20,24)