5-(4-fluorophenyl)-6-methyl-2-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-fluorophenyl)-6-methyl-2-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-fluorophenyl)-6-methyl-2-[2-(4-methyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-fluorophenyl)-6-methyl-2-[[2-(4-methyl-1-piperidinyl)-2-oxoethyl]thio]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-(4-fluorophenyl)-6-methyl-2-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-fluorophenyl)-2-[[2-keto-2-(4-methylpiperidino)ethyl]thio]-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H22FN3O2S2 MolecularWeight: 431.546683

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CSC2=NC3=C(C(=C(S3)C)C4=CC=C(C=C4)F)C(=O)N2

Isomeric SMILES

CC1CCN(CC1)C(=O)CSC2=NC3=C(C(=C(S3)C)C4=CC=C(C=C4)F)C(=O)N2

InChI

InChI=1S/C21H22FN3O2S2/c1-12-7-9-25(10-8-12)16(26)11-28-21-23-19(27)18-17(13(2)29-20(18)24-21)14-3-5-15(22)6-4-14/h3-6,12H,7-11H2,1-2H3,(H,23,24,27)