5-ethyl-6-methyl-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-3-[[(2R)-oxolan-2-yl]methyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-ethyl-6-methyl-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-3-[[(2R)-oxolan-2-yl]methyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-ethyl-6-methyl-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 5-ethyl-6-methyl-3-[[(2R)-2-oxolanyl]methyl]-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-ethyl-6-methyl-3-[[(2R)-oxolan-2-yl]methyl]-2-(2-oxo-2-piperidin-1-ylethyl)sulfanylthieno[2,3-d]pyrimidin-4-one Traditional Name: 5-ethyl-2-[(2-keto-2-piperidino-ethyl)thio]-6-methyl-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thieno[2,3-d]pyrimidin-4-one Formula: C21H29N3O3S2 MolecularWeight: 435.60326

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)N3CCCCC3)CC4CCCO4)C

Isomeric SMILES

CCC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)N3CCCCC3)C[C@H]4CCCO4)C

InChI

InChI=1S/C21H29N3O3S2/c1-3-16-14(2)29-19-18(16)20(26)24(12-15-8-7-11-27-15)21(22-19)28-13-17(25)23-9-5-4-6-10-23/h15H,3-13H2,1-2H3/t15-/m1/s1