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

Systemtic Name: 5,6-dimethyl-2-[[1-(3-methylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-[[1-methyl-2-(3-methyl-1-piperidyl)-2-oxo-ethyl]sulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[[[1-(3-methyl-1-piperidinyl)-1-oxopropan-2-yl]thio]methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5,6-dimethyl-2-[[1-(3-methylpiperidin-1-yl)-1-oxopropan-2-yl]sulfanylmethyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[[2-keto-1-methyl-2-(3-methylpiperidino)ethyl]thio]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C18H25N3O2S2 MolecularWeight: 379.54

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C(C)SCC2=NC3=C(C(=C(S3)C)C)C(=O)N2

Isomeric SMILES

CC1CCCN(C1)C(=O)C(C)SCC2=NC3=C(C(=C(S3)C)C)C(=O)N2

InChI

InChI=1S/C18H25N3O2S2/c1-10-6-5-7-21(8-10)18(23)13(4)24-9-14-19-16(22)15-11(2)12(3)25-17(15)20-14/h10,13H,5-9H2,1-4H3,(H,19,20,22)