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

Systemtic Name: 2-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[2-[(2S)-2-ethyl-1-piperidyl]-2-oxo-ethyl]sulfanyl-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[2-[(2S)-2-ethyl-1-piperidinyl]-2-oxoethyl]thio]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl]sulfanyl-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[2-[(2S)-2-ethylpiperidino]-2-keto-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:

CCC1CCCCN1C(=O)CSC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2

Isomeric SMILES

CC[C@H]1CCCCN1C(=O)CSC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2

InChI

InChI=1S/C19H21N3O2S3/c1-2-12-6-3-4-8-22(12)15(23)11-27-19-20-17(24)16-13(10-26-18(16)21-19)14-7-5-9-25-14/h5,7,9-10,12H,2-4,6,8,11H2,1H3,(H,20,21,24)/t12-/m0/s1