2-[(2S)-1-(4-methylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(2S)-1-(4-methylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(1S)-1-methyl-2-(4-methyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[(2S)-1-(4-methyl-1-piperidinyl)-1-oxopropan-2-yl]thio]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(2S)-1-(4-methylpiperidin-1-yl)-1-oxopropan-2-yl]sulfanyl-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[(1S)-2-keto-1-methyl-2-(4-methylpiperidino)ethyl]thio]-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C19H21N3O2S3 MolecularWeight: 419.58394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C(C)SC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2

Isomeric SMILES

CC1CCN(CC1)C(=O)[C@H](C)SC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2

InChI

InChI=1S/C19H21N3O2S3/c1-11-5-7-22(8-6-11)18(24)12(2)27-19-20-16(23)15-13(10-26-17(15)21-19)14-4-3-9-25-14/h3-4,9-12H,5-8H2,1-2H3,(H,20,21,23)/t12-/m0/s1