3-butyl-5,6-dimethyl-2-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-butyl-5,6-dimethyl-2-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-butyl-5,6-dimethyl-2-[[2-(2-thienyl)oxazol-4-yl]methylsulfanyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-butyl-5,6-dimethyl-2-[(2-thiophen-2-yl-4-oxazolyl)methylthio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-butyl-5,6-dimethyl-2-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-butyl-5,6-dimethyl-2-[[2-(2-thienyl)oxazol-4-yl]methylthio]thieno[2,3-d]pyrimidin-4-one Formula: C20H21N3O2S3 MolecularWeight: 431.59464

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(N=C1SCC3=COC(=N3)C4=CC=CS4)SC(=C2C)C

Isomeric SMILES

CCCCN1C(=O)C2=C(N=C1SCC3=COC(=N3)C4=CC=CS4)SC(=C2C)C

InChI

InChI=1S/C20H21N3O2S3/c1-4-5-8-23-19(24)16-12(2)13(3)28-18(16)22-20(23)27-11-14-10-25-17(21-14)15-7-6-9-26-15/h6-7,9-10H,4-5,8,11H2,1-3H3