3-(3,5-dimethylphenyl)-6-methyl-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-6,7-dihydrothieno[3,2-d]pyrimidin-4-one

Systemtic Name: 3-(3,5-dimethylphenyl)-6-methyl-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-6,7-dihydrothieno[3,2-d]pyrimidin-4-one Openeye Name: 3-(3,5-dimethylphenyl)-6-methyl-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-6,7-dihydrothieno[3,2-d]pyrimidin-4-one CAS Name: 3-(3,5-dimethylphenyl)-6-methyl-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-6,7-dihydrothieno[3,2-d]pyrimidin-4-one IUPAC Name: 3-(3,5-dimethylphenyl)-6-methyl-2-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-6,7-dihydrothieno[3,2-d]pyrimidin-4-one Traditional Name: 3-(3,5-dimethylphenyl)-2-[(2-keto-2-piperidino-ethyl)thio]-6-methyl-6,7-dihydrothieno[3,2-d]pyrimidin-4-one Formula: C22H27N3O2S2 MolecularWeight: 429.59868

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(S1)C(=O)N(C(=N2)SCC(=O)N3CCCCC3)C4=CC(=CC(=C4)C)C

Isomeric SMILES

CC1CC2=C(S1)C(=O)N(C(=N2)SCC(=O)N3CCCCC3)C4=CC(=CC(=C4)C)C

InChI

InChI=1S/C22H27N3O2S2/c1-14-9-15(2)11-17(10-14)25-21(27)20-18(12-16(3)29-20)23-22(25)28-13-19(26)24-7-5-4-6-8-24/h9-11,16H,4-8,12-13H2,1-3H3