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

Systemtic Name: 3-(2,4-dimethylphenyl)-5,6-dimethyl-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-(2,4-dimethylphenyl)-5,6-dimethyl-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-(2,4-dimethylphenyl)-5,6-dimethyl-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-(2,4-dimethylphenyl)-5,6-dimethyl-2-(2-oxo-2-piperidin-1-ylethyl)sulfanylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(2,4-dimethylphenyl)-2-[(2-keto-2-piperidino-ethyl)thio]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C23H27N3O2S2 MolecularWeight: 441.60938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)N4CCCCC4)SC(=C3C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)N4CCCCC4)SC(=C3C)C)C

InChI

InChI=1S/C23H27N3O2S2/c1-14-8-9-18(15(2)12-14)26-22(28)20-16(3)17(4)30-21(20)24-23(26)29-13-19(27)25-10-6-5-7-11-25/h8-9,12H,5-7,10-11,13H2,1-4H3