2-[[1-(4-cyclopentylpiperazin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[[1-(4-cyclopentylpiperazin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[[2-(4-cyclopentylpiperazin-1-yl)-1-methyl-2-oxo-ethyl]sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[[1-(4-cyclopentyl-1-piperazinyl)-1-oxopropan-2-yl]thio]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[[1-(4-cyclopentylpiperazin-1-yl)-1-oxopropan-2-yl]sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[[2-(4-cyclopentylpiperazino)-2-keto-1-methyl-ethyl]thio]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H30N4O2S2 MolecularWeight: 434.6185

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CSC(C)C(=O)N3CCN(CC3)C4CCCC4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CSC(C)C(=O)N3CCN(CC3)C4CCCC4)C

InChI

InChI=1S/C21H30N4O2S2/c1-13-14(2)29-20-18(13)19(26)22-17(23-20)12-28-15(3)21(27)25-10-8-24(9-11-25)16-6-4-5-7-16/h15-16H,4-12H2,1-3H3,(H,22,23,26)