2-[[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanylmethyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanylmethyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[[2-(3,5-dimethyl-1-piperidyl)-2-oxo-ethyl]sulfanylmethyl]-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[[2-(3,5-dimethyl-1-piperidinyl)-2-oxoethyl]thio]methyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]sulfanylmethyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[[2-(3,5-dimethylpiperidino)-2-keto-ethyl]thio]methyl]-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C20H23N3O2S3 MolecularWeight: 433.61052

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CSCC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)CSCC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2)C

InChI

InChI=1S/C20H23N3O2S3/c1-12-6-13(2)8-23(7-12)17(24)11-26-10-16-21-19(25)18-14(9-28-20(18)22-16)15-4-3-5-27-15/h3-5,9,12-13H,6-8,10-11H2,1-2H3,(H,21,22,25)