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

Systemtic Name: 3-butyl-5,6-dimethyl-2-[2-oxidanylidene-2-(2-thiophen-2-ylpyrrolidin-1-yl)ethyl]sulfanyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-butyl-5,6-dimethyl-2-[2-oxo-2-[2-(2-thienyl)pyrrolidin-1-yl]ethyl]sulfanyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-butyl-5,6-dimethyl-2-[[2-oxo-2-(2-thiophen-2-yl-1-pyrrolidinyl)ethyl]thio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-butyl-5,6-dimethyl-2-[2-oxo-2-(2-thiophen-2-ylpyrrolidin-1-yl)ethyl]sulfanylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-butyl-2-[[2-keto-2-[2-(2-thienyl)pyrrolidino]ethyl]thio]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C22H27N3O2S3 MolecularWeight: 461.66368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(N=C1SCC(=O)N3CCCC3C4=CC=CS4)SC(=C2C)C

Isomeric SMILES

CCCCN1C(=O)C2=C(N=C1SCC(=O)N3CCCC3C4=CC=CS4)SC(=C2C)C

InChI

InChI=1S/C22H27N3O2S3/c1-4-5-10-25-21(27)19-14(2)15(3)30-20(19)23-22(25)29-13-18(26)24-11-6-8-16(24)17-9-7-12-28-17/h7,9,12,16H,4-6,8,10-11,13H2,1-3H3